MechGen ! Fri Mar 23 15:47:13 2001 PST ! PARMS 24 OHRR OHA2 OHNR OHR2 OHA3 OHK3 OHXC OHK4 OHK6 OHTO OHA1 OHME OHQ2 OHCO OHXX OHQ1 OHGL OHMG OHRH OHZ1 OHC2 OHZ2 OHZ3 OHBA ! ! MechGen conditions : ! MechGen_version= SAPRC-2000b; temperature= 300.0; pressure= 1.0; O2_fac= 0.2 ! 0946; de_minimus_yield= 0.01; no_HORONO2_from_alkanes= 0; mech_asn_set= SAPR ! C-2000 Mechanism Assignments; lumping= SAPRC-99B Lumping ! ETHANE : CH3-CH3 ! K(OH) 1.370e-12 0.990 2.00 ! kOH from: Atkinson (1997a) OHRR 1.000 ! RO2-R. OHA2 1.000 ! CCHO ! OH reaction generated Fri Mar 16 09:37:08 2001 PST ! PROPANE : CH3-CH2-CH3 ! K(OH) 1.400e-12 0.121 2.00 ! kOH from: Atkinson (1997a) OHRR 0.965 ! RO2-R. OHNR 0.035 ! RO2-N. OHR2 0.000 ! R2O2. OHA3 0.261 ! RCHO OHK3 0.704 ! ACET OHXC -0.104 ! C bal. calc. ! OH reaction generated Fri Mar 16 09:37:09 2001 PST ! N-C4 : CH3-CH2-CH2-CH3 ! K(OH) 1.520e-12 -0.288 2.00 ! kOH from: Atkinson (1997a) OHRR 0.921 ! RO2-R. OHNR 0.079 ! RO2-N. OHR2 0.413 ! R2O2. OHA2 0.632 ! CCHO OHA3 0.120 ! RCHO OHK4 0.485 ! MEK OHXC -0.038 ! C bal. calc. ! OH reaction generated Fri Mar 16 09:37:10 2001 PST ! N-C5 : CH3-CH2-CH2-CH2-CH3 ! K(OH) 2.200e-12 -0.364 2.00 ! kOH from: Atkinson (1997a) OHRR 0.855 ! RO2-R. OHNR 0.145 ! RO2-N. OHR2 0.650 ! R2O2. OHA2 0.147 ! CCHO OHA3 0.220 ! RCHO OHK4 0.238 ! MEK OHK6 0.397 ! PROD2 OHXC -0.157 ! C bal. calc. ! OH reaction generated Fri Mar 16 09:37:12 2001 PST ! N-C6 : CH3-CH2-CH2-CH2-CH2-CH3 ! K(OH) 1.380e-12 -0.823 2.00 ! kOH from: Atkinson (1997a) OHRR 0.775 ! RO2-R. OHNR 0.225 ! RO2-N. OHR2 0.787 ! R2O2. OHA2 0.011 ! CCHO OHA3 0.113 ! RCHO OHK6 0.688 ! PROD2 OHXC 0.162 ! C bal. calc. ! OH reaction generated Fri Mar 16 09:37:16 2001 PST ! N-C7 : CH3-CH2-CH2-CH2-CH2-CH2-CH3 ! K(OH) 1.430e-12 -0.950 2.00 ! kOH from: Atkinson (1997a) OHRR 0.705 ! RO2-R. OHNR 0.295 ! RO2-N. OHR2 0.799 ! R2O2. OHA3 0.055 ! RCHO OHK6 0.659 ! PROD2 OHXC 1.110 ! C bal. calc. ! OH reaction generated Fri Mar 16 09:37:21 2001 PST ! N-C8 : CH3-CH2-CH2-CH2-CH2-CH2-CH2-CH3 ! K(OH) 2.480e-12 -0.751 2.00 ! kOH from: Atkinson (1997a) OHRR 0.646 ! RO2-R. OHNR 0.354 ! RO2-N. OHR2 0.786 ! R2O2. OHA3 0.024 ! RCHO OHK6 0.622 ! PROD2 OHXC 2.073 ! C bal. calc. ! OH reaction generated Fri Mar 16 09:37:27 2001 PST ! N-C9 : CH3-CH2-CH2-CH2-CH2-CH2-CH2-CH2-CH3 ! K(OH) 2.260e-12 -0.888 2.00 ! kOH from: Atkinson (1997a) OHRR 0.602 ! RO2-R. OHNR 0.398 ! RO2-N. OHR2 0.777 ! R2O2. OHA3 0.018 ! RCHO OHK6 0.584 ! PROD2 OHXC 3.055 ! C bal. calc. ! OH reaction generated Fri Mar 16 09:37:38 2001 PST ! N-C10 : CH3-CH2-CH2-CH2-CH2-CH2-CH2-CH2-CH2-CH3 ! K(OH) 2.820e-12 -0.827 2.00 ! kOH from: Atkinson (1997a) OHRR 0.572 ! RO2-R. OHNR 0.428 ! RO2-N. OHR2 0.772 ! R2O2. OHA3 0.015 ! RCHO OHK6 0.557 ! PROD2 OHXC 4.045 ! C bal. calc. ! OH reaction generated Fri Mar 16 09:37:51 2001 PST ! N-C11 : CH3-CH2-CH2-CH2-CH2-CH2-CH2-CH2-CH2-CH2-CH3 ! K(OH) 1.290e-11 ! kOH for T=298 only. ! kOH from: Atkinson (1997a) OHRR 0.553 ! RO2-R. OHNR 0.447 ! RO2-N. OHR2 0.771 ! R2O2. OHA3 0.013 ! RCHO OHK6 0.540 ! PROD2 OHXC 5.038 ! C bal. calc. ! OH reaction generated Fri Mar 16 09:38:11 2001 PST ! N-C12 : CH3-CH2-CH2-CH2-CH2-CH2-CH2-CH2-CH2-CH2-CH2-CH3 ! K(OH) 1.390e-11 ! kOH for T=298 only. ! kOH from: Atkinson (1997a) OHRR 0.542 ! RO2-R. OHNR 0.458 ! RO2-N. OHR2 0.768 ! R2O2. OHA3 0.011 ! RCHO OHK6 0.530 ! PROD2 OHXC 6.034 ! C bal. calc. ! OH reaction generated Fri Mar 16 09:38:36 2001 PST ! N-C13 : CH3-CH2-CH2-CH2-CH2-CH2-CH2-CH2-CH2-CH2-CH2-CH2-CH3 ! K(OH) 1.600e-11 ! kOH for T=298 only. ! kOH from: Atkinson (1997a) OHRR 0.535 ! RO2-R. OHNR 0.465 ! RO2-N. OHR2 0.766 ! R2O2. OHA3 0.010 ! RCHO OHK6 0.525 ! PROD2 OHXC 7.030 ! C bal. calc. ! OH reaction generated Fri Mar 16 09:39:10 2001 PST ! N-C14 : CH3-CH2-CH2-CH2-CH2-CH2-CH2-CH2-CH2-CH2-CH2-CH2-CH2-CH3 ! K(OH) 1.800e-11 ! kOH for T=298 only. ! kOH from: Atkinson (1997a) OHRR 0.530 ! RO2-R. OHNR 0.470 ! RO2-N. OHR2 0.765 ! R2O2. OHA3 0.009 ! RCHO OHK6 0.521 ! PROD2 OHXC 8.027 ! C bal. calc. ! OH reaction generated Fri Mar 16 09:39:51 2001 PST ! N-C15 : CH3-CH2-CH2-CH2-CH2-CH2-CH2-CH2-CH2-CH2-CH2-CH2-CH2-CH2-CH3 ! K(OH) 2.100e-11 ! kOH for T=298 only. ! kOH from: Atkinson (1997a) OHRR 0.527 ! RO2-R. OHNR 0.473 ! RO2-N. OHR2 0.764 ! R2O2. OHA3 0.008 ! RCHO OHK6 0.519 ! PROD2 OHXC 9.025 ! C bal. calc. ! OH reaction generated Fri Mar 16 09:40:47 2001 PST ! N-C16 : CH3-CH2-CH2-CH2-CH2-CH2-CH2-CH2-CH2-CH2-CH2-CH2-CH2-CH2-CH2-CH3 ! K(OH) 2.300e-11 ! kOH for T=298 only. ! kOH from: Atkinson (1997a) OHRR 0.525 ! RO2-R. OHNR 0.475 ! RO2-N. OHR2 0.763 ! R2O2. OHA3 0.008 ! RCHO OHK6 0.517 ! PROD2 OHXC 10.023 ! C bal. calc. ! OH reaction generated Fri Mar 16 09:41:55 2001 PST ! 2-ME-C3 : CH3-CH(CH3)-CH3 ! K(OH) 1.040e-12 -0.447 2.00 ! kOH from: Atkinson (1997a) OHRR 0.198 ! RO2-R. OHNR 0.042 ! RO2-N. OHR2 0.833 ! R2O2. OHTO 0.760 ! TBU-O. OHA1 0.073 ! HCHO OHA3 0.128 ! RCHO OHK3 0.070 ! ACET OHXC 0.800 ! C bal. calc. ! OH reaction generated Fri Mar 16 09:41:57 2001 PST ! 22-DM-C3 : CH3-C(CH3)(CH3)-CH3 ! K(OH) 1.620e-12 0.376 2.00 ! kOH from: Atkinson (1997a) OHRR 0.021 ! RO2-R. OHNR 0.088 ! RO2-N. OHR2 1.819 ! R2O2. OHTO 0.891 ! TBU-O. OHA1 0.928 ! HCHO OHA3 0.021 ! RCHO OHXC 0.809 ! C bal. calc. ! OH reaction generated Fri Mar 16 09:41:58 2001 PST ! 2-ME-C4 : CH3-CH(CH3)-CH2-CH3 ! K(OH) 3.700e-12 ! kOH for T=298 only. ! kOH from: Atkinson (1997a) OHRR 0.881 ! RO2-R. OHNR 0.095 ! RO2-N. OHR2 0.902 ! R2O2. OHME 0.024 ! C-O2. OHA1 0.012 ! HCHO OHA2 0.780 ! CCHO OHA3 0.101 ! RCHO OHK3 0.762 ! ACET OHK4 0.038 ! MEK OHXC 0.094 ! C bal. calc. ! OH reaction generated Fri Mar 16 09:42:01 2001 PST ! 22-DM-C4 : CH3-C(CH3)(CH3)-CH2-CH3 ! K(OH) 3.220e-11 1.552 0.00 ! kOH from: Atkinson (1997a) OHRR 0.304 ! RO2-R. OHNR 0.176 ! RO2-N. OHR2 1.581 ! R2O2. OHME 0.009 ! C-O2. OHTO 0.510 ! TBU-O. OHA1 0.227 ! HCHO OHA2 0.730 ! CCHO OHA3 0.103 ! RCHO OHK3 0.202 ! ACET OHK4 0.009 ! MEK OHK6 0.000 ! PROD2 OHXC 0.765 ! C bal. calc. ! OH reaction generated Fri Mar 16 09:42:06 2001 PST ! 23-DM-C4 : CH3-CH(CH3)-CH(CH3)-CH3 ! K(OH) 1.120e-12 -0.982 2.00 ! kOH from: Atkinson (1997a) OHRR 0.858 ! RO2-R. OHNR 0.142 ! RO2-N. OHR2 0.918 ! R2O2. OHA1 0.028 ! HCHO OHA2 0.023 ! CCHO OHA3 0.078 ! RCHO OHK3 1.569 ! ACET OHK4 0.001 ! MEK OHXC 0.132 ! C bal. calc. ! OH reaction generated Fri Mar 16 09:42:10 2001 PST ! 2-ME-C5 : CH3-CH(CH3)-CH2-CH2-CH3 ! K(OH) 5.300e-12 ! kOH for T=298 only. ! kOH from: Atkinson (1997a) OHRR 0.816 ! RO2-R. OHNR 0.184 ! RO2-N. OHR2 0.859 ! R2O2. OHA1 0.004 ! HCHO OHA2 0.011 ! CCHO OHA3 0.661 ! RCHO OHK3 0.346 ! ACET OHK4 0.006 ! MEK OHK6 0.153 ! PROD2 OHXC 0.904 ! C bal. calc. ! OH reaction generated Fri Mar 16 09:42:15 2001 PST ! 3-ME-C5 : CH3-CH2-CH(CH3)-CH2-CH3 ! K(OH) 5.400e-12 ! kOH for T=298 only. ! kOH from: Atkinson (1997a) OHRR 0.844 ! RO2-R. OHNR 0.156 ! RO2-N. OHR2 0.989 ! R2O2. OHA1 0.005 ! HCHO OHA2 0.986 ! CCHO OHA3 0.069 ! RCHO OHK4 0.629 ! MEK OHK6 0.036 ! PROD2 OHXC 0.151 ! C bal. calc. ! OH reaction generated Fri Mar 16 09:42:21 2001 PST ! 223TM-C4 : CH3-C(CH3)(CH3)-CH(CH3)-CH3 ! K(OH) 7.610e-13 -1.025 2.00 ! kOH from: Atkinson (1997a) OHRR 0.183 ! RO2-R. OHNR 0.192 ! RO2-N. OHR2 1.631 ! R2O2. OHTO 0.625 ! TBU-O. OHA1 0.160 ! HCHO OHA2 0.022 ! CCHO OHA3 0.065 ! RCHO OHK3 0.870 ! ACET OHK4 0.000 ! MEK OHK6 0.000 ! PROD2 OHXC 0.964 ! C bal. calc. ! OH reaction generated Fri Mar 16 09:42:28 2001 PST ! 22-DM-C5 : CH3-C(CH3)(CH3)-CH2-CH2-CH3 ! K(OH) 3.400e-12 ! kOH for T=298 only. ! kOH from: Atkinson (1997a) OHRR 0.441 ! RO2-R. OHNR 0.209 ! RO2-N. OHR2 1.191 ! R2O2. OHTO 0.350 ! TBU-O. OHA1 0.056 ! HCHO OHA2 0.017 ! CCHO OHA3 0.516 ! RCHO OHK3 0.014 ! ACET OHK4 0.017 ! MEK OHK6 0.257 ! PROD2 OHXC 1.408 ! C bal. calc. ! OH reaction generated Fri Mar 16 09:42:37 2001 PST ! 23-DM-C5 : CH3-CH(CH3)-CH(CH3)-CH2-CH3 ! K(OH) 7.153e-12 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.783 ! RO2-R. OHNR 0.217 ! RO2-N. OHR2 1.090 ! R2O2. OHA1 0.015 ! HCHO OHA2 0.453 ! CCHO OHA3 0.061 ! RCHO OHK3 0.733 ! ACET OHK4 0.517 ! MEK OHK6 0.010 ! PROD2 OHXC 0.269 ! C bal. calc. ! OH reaction generated Fri Mar 16 09:43:00 2001 PST ! 24-DM-C5 : CH3-CH(CH3)-CH2-CH(CH3)-CH3 ! K(OH) 5.000e-12 ! kOH for T=298 only. ! kOH from: Atkinson (1997a) OHRR 0.796 ! RO2-R. OHNR 0.204 ! RO2-N. OHR2 1.323 ! R2O2. OHA1 0.333 ! HCHO OHA2 0.016 ! CCHO OHA3 0.562 ! RCHO OHK3 0.483 ! ACET OHK4 0.013 ! MEK OHK6 0.135 ! PROD2 OHXC 1.413 ! C bal. calc. ! OH reaction generated Fri Mar 16 09:43:07 2001 PST ! 2-ME-C6 : CH3-CH(CH3)-CH2-CH2-CH2-CH3 ! K(OH) 6.894e-12 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.731 ! RO2-R. OHNR 0.269 ! RO2-N. OHR2 0.906 ! R2O2. OHA1 0.022 ! HCHO OHA2 0.048 ! CCHO OHA3 0.236 ! RCHO OHK3 0.137 ! ACET OHK6 0.508 ! PROD2 OHXC 1.102 ! C bal. calc. ! OH reaction generated Fri Mar 16 09:43:15 2001 PST ! 33-DM-C5 : CH3-CH2-C(CH3)(CH3)-CH2-CH3 ! K(OH) 2.996e-12 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.737 ! RO2-R. OHNR 0.238 ! RO2-N. OHR2 1.593 ! R2O2. OHME 0.025 ! C-O2. OHA1 0.163 ! HCHO OHA2 1.328 ! CCHO OHA3 0.046 ! RCHO OHK3 0.618 ! ACET OHK4 0.096 ! MEK OHK6 0.002 ! PROD2 OHXC 0.340 ! C bal. calc. ! OH reaction generated Fri Mar 16 09:43:22 2001 PST ! 3-ME-C6 : CH3-CH2-CH(CH3)-CH2-CH2-CH3 ! K(OH) 7.174e-12 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.750 ! RO2-R. OHNR 0.250 ! RO2-N. OHR2 0.924 ! R2O2. OHA1 0.002 ! HCHO OHA2 0.208 ! CCHO OHA3 0.463 ! RCHO OHK4 0.256 ! MEK OHK6 0.235 ! PROD2 OHXC 1.266 ! C bal. calc. ! OH reaction generated Fri Mar 16 09:43:40 2001 PST ! 2233M-C4 : CH3-C(CH3)(CH3)-C(CH3)(CH3)-CH3 ! K(OH) 1.720e-12 0.286 2.00 ! kOH from: Atkinson (1997a) OHRR 0.067 ! RO2-R. OHNR 0.316 ! RO2-N. OHR2 2.106 ! R2O2. OHTO 0.617 ! TBU-O. OHA1 0.761 ! HCHO OHA3 0.059 ! RCHO OHK3 0.659 ! ACET OHK4 0.000 ! MEK OHK6 0.000 ! PROD2 OHXC 1.337 ! C bal. calc. ! OH reaction generated Fri Mar 16 09:43:50 2001 PST ! 224TM-C5 : CH3-C(CH3)(CH3)-CH2-CH(CH3)-CH3 ! K(OH) 1.870e-12 -0.389 2.00 ! kOH from: Atkinson (1997a) OHRR 0.403 ! RO2-R. OHNR 0.227 ! RO2-N. OHR2 1.961 ! R2O2. OHTO 0.370 ! TBU-O. OHA1 0.717 ! HCHO OHA2 0.002 ! CCHO OHA3 0.388 ! RCHO OHK3 0.380 ! ACET OHK4 0.133 ! MEK OHK6 0.027 ! PROD2 OHXC 1.809 ! C bal. calc. ! OH reaction generated Fri Mar 16 09:44:06 2001 PST ! 22-DM-C6 : CH3-C(CH3)(CH3)-CH2-CH2-CH2-CH3 ! K(OH) 4.800e-12 ! kOH for T=298 only. ! kOH from: Atkinson (1997a) OHRR 0.457 ! RO2-R. OHNR 0.290 ! RO2-N. OHR2 0.953 ! R2O2. OHTO 0.253 ! TBU-O. OHA1 0.035 ! HCHO OHA2 0.041 ! CCHO OHA3 0.367 ! RCHO OHK3 0.001 ! ACET OHK4 0.013 ! MEK OHK6 0.341 ! PROD2 OHXC 2.183 ! C bal. calc. ! OH reaction generated Fri Mar 16 09:44:19 2001 PST ! 234TM-C5 : CH3-CH(CH3)-CH(CH3)-CH(CH3)-CH3 ! K(OH) 7.100e-12 ! kOH for T=298 only. ! kOH from: Atkinson (1997a) OHRR 0.717 ! RO2-R. OHNR 0.283 ! RO2-N. OHR2 1.284 ! R2O2. OHA1 0.039 ! HCHO OHA2 0.447 ! CCHO OHA3 0.033 ! RCHO OHK3 1.141 ! ACET OHK4 0.296 ! MEK OHK6 0.000 ! PROD2 OHXC 0.664 ! C bal. calc. ! OH reaction generated Fri Mar 16 09:44:47 2001 PST ! 23-DM-C6 : CH3-CH(CH3)-CH(CH3)-CH2-CH2-CH3 ! K(OH) 8.574e-12 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.700 ! RO2-R. OHNR 0.300 ! RO2-N. OHR2 1.143 ! R2O2. OHA1 0.014 ! HCHO OHA2 0.128 ! CCHO OHA3 0.184 ! RCHO OHK3 0.561 ! ACET OHK4 0.299 ! MEK OHK6 0.250 ! PROD2 OHXC 1.000 ! C bal. calc. ! OH reaction generated Fri Mar 16 09:45:14 2001 PST ! 24-DM-C6 : CH3-CH(CH3)-CH2-CH(CH3)-CH2-CH3 ! K(OH) 8.574e-12 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.652 ! RO2-R. OHNR 0.348 ! RO2-N. OHR2 1.346 ! R2O2. OHA1 0.159 ! HCHO OHA2 0.335 ! CCHO OHA3 0.306 ! RCHO OHK3 0.096 ! ACET OHK4 0.156 ! MEK OHK6 0.293 ! PROD2 OHXC 1.492 ! C bal. calc. ! OH reaction generated Fri Mar 16 09:45:41 2001 PST ! 25-DM-C6 : CH3-CH(CH3)-CH2-CH2-CH(CH3)-CH3 ! K(OH) 8.293e-12 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.649 ! RO2-R. OHNR 0.351 ! RO2-N. OHR2 1.530 ! R2O2. OHA1 0.156 ! HCHO OHA3 0.434 ! RCHO OHK3 0.569 ! ACET OHK6 0.225 ! PROD2 OHXC 1.378 ! C bal. calc. ! OH reaction generated Fri Mar 16 09:45:48 2001 PST ! 2-ME-C7 : CH3-CH(CH3)-CH2-CH2-CH2-CH2-CH3 ! K(OH) 8.314e-12 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.659 ! RO2-R. OHNR 0.341 ! RO2-N. OHR2 0.882 ! R2O2. OHA1 0.016 ! HCHO OHA2 0.025 ! CCHO OHA3 0.155 ! RCHO OHK3 0.024 ! ACET OHK6 0.546 ! PROD2 OHXC 2.077 ! C bal. calc. ! OH reaction generated Fri Mar 16 09:46:00 2001 PST ! 3-ME-C7 : CH3-CH2-CH(CH3)-CH2-CH2-CH2-CH3 ! K(OH) 8.594e-12 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.662 ! RO2-R. OHNR 0.338 ! RO2-N. OHR2 0.942 ! R2O2. OHA1 0.001 ! HCHO OHA2 0.178 ! CCHO OHA3 0.150 ! RCHO OHK4 0.062 ! MEK OHK6 0.521 ! PROD2 OHXC 1.788 ! C bal. calc. ! OH reaction generated Fri Mar 16 09:46:22 2001 PST ! 4-ME-C7 : CH3-CH2-CH2-CH(CH3)-CH2-CH2-CH3 ! K(OH) 8.594e-12 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.676 ! RO2-R. OHNR 0.324 ! RO2-N. OHR2 0.875 ! R2O2. OHA1 0.002 ! HCHO OHA2 0.004 ! CCHO OHA3 0.377 ! RCHO OHK4 0.115 ! MEK OHK6 0.376 ! PROD2 OHXC 2.201 ! C bal. calc. ! OH reaction generated Fri Mar 16 09:46:35 2001 PST ! 225TM-C6 : CH3-C(CH3)(CH3)-CH2-CH2-CH(CH3)-CH3 ! K(OH) 6.079e-12 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.475 ! RO2-R. OHNR 0.330 ! RO2-N. OHR2 1.307 ! R2O2. OHTO 0.195 ! TBU-O. OHA1 0.046 ! HCHO OHA2 0.002 ! CCHO OHA3 0.613 ! RCHO OHK3 0.433 ! ACET OHK4 0.004 ! MEK OHK6 0.056 ! PROD2 OHXC 2.899 ! C bal. calc. ! OH reaction generated Fri Mar 16 09:46:49 2001 PST ! 235TM-C6 : CH3-CH(CH3)-CH(CH3)-CH2-CH(CH3)-CH3 ! K(OH) 7.900e-12 ! kOH for T=298 only. ! kOH from: Atkinson (1997a) OHRR 0.622 ! RO2-R. OHNR 0.378 ! RO2-N. OHR2 1.356 ! R2O2. OHA1 0.094 ! HCHO OHA2 0.104 ! CCHO OHA3 0.178 ! RCHO OHK3 0.630 ! ACET OHK4 0.017 ! MEK OHK6 0.436 ! PROD2 OHXC 1.327 ! C bal. calc. ! OH reaction generated Fri Mar 16 09:47:35 2001 PST ! 24-DM-C7 : CH3-CH(CH3)-CH2-CH(CH3)-CH2-CH2-CH3 ! K(OH) 9.994e-12 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.598 ! RO2-R. OHNR 0.402 ! RO2-N. OHR2 1.176 ! R2O2. OHA1 0.104 ! HCHO OHA2 0.013 ! CCHO OHA3 0.410 ! RCHO OHK3 0.049 ! ACET OHK4 0.073 ! MEK OHK6 0.381 ! PROD2 OHXC 2.501 ! C bal. calc. ! OH reaction generated Fri Mar 16 09:48:12 2001 PST ! 2-ME-C8 : CH3-CH(CH3)-CH2-CH2-CH2-CH2-CH2-CH3 ! K(OH) 1.010e-11 ! kOH for T=298 only. ! kOH from: Atkinson (1997a) OHRR 0.587 ! RO2-R. OHNR 0.413 ! RO2-N. OHR2 0.914 ! R2O2. OHA1 0.002 ! HCHO OHA3 0.064 ! RCHO OHK3 0.014 ! ACET OHK6 0.536 ! PROD2 OHXC 3.072 ! C bal. calc. ! OH reaction generated Fri Mar 16 09:48:27 2001 PST ! 33-DE-C5 : CH3-CH2-C(CH2-CH3)(CH2-CH3)-CH2-CH3 ! K(OH) 4.900e-12 ! kOH for T=298 only. ! kOH from: Atkinson (1997a) OHRR 0.647 ! RO2-R. OHNR 0.353 ! RO2-N. OHR2 1.450 ! R2O2. OHA1 0.053 ! HCHO OHA2 1.321 ! CCHO OHA3 0.022 ! RCHO OHK4 0.607 ! MEK OHK6 0.018 ! PROD2 OHXC 1.585 ! C bal. calc. ! OH reaction generated Fri Mar 16 09:48:31 2001 PST ! 35-DM-C7 : CH3-CH2-CH(CH3)-CH2-CH(CH3)-CH2-CH3 ! K(OH) 1.027e-11 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.549 ! RO2-R. OHNR 0.451 ! RO2-N. OHR2 1.467 ! R2O2. OHA1 0.010 ! HCHO OHA2 0.648 ! CCHO OHA3 0.155 ! RCHO OHK4 0.075 ! MEK OHK6 0.399 ! PROD2 OHXC 1.830 ! C bal. calc. ! OH reaction generated Fri Mar 16 09:49:05 2001 PST ! 4-ET-C7 : CH3-CH2-CH2-CH(CH2-CH3)-CH2-CH2-CH3 ! K(OH) 1.042e-11 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.633 ! RO2-R. OHNR 0.367 ! RO2-N. OHR2 0.862 ! R2O2. OHA1 0.001 ! HCHO OHA2 0.049 ! CCHO OHA3 0.328 ! RCHO OHK6 0.486 ! PROD2 OHXC 2.799 ! C bal. calc. ! OH reaction generated Fri Mar 16 09:49:38 2001 PST ! 4-ME-C8 : CH3-CH2-CH2-CH(CH3)-CH2-CH2-CH2-CH3 ! K(OH) 9.700e-12 ! kOH for T=298 only. ! kOH from: Atkinson (1997a) OHRR 0.605 ! RO2-R. OHNR 0.395 ! RO2-N. OHR2 0.890 ! R2O2. OHA1 0.001 ! HCHO OHA2 0.034 ! CCHO OHA3 0.127 ! RCHO OHK4 0.006 ! MEK OHK6 0.562 ! PROD2 OHXC 2.788 ! C bal. calc. ! OH reaction generated Fri Mar 16 09:50:15 2001 PST ! 24-DM-C8 : CH3-CH(CH3)-CH2-CH(CH3)-CH2-CH2-CH2-CH3 ! K(OH) 1.141e-11 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.555 ! RO2-R. OHNR 0.445 ! RO2-N. OHR2 1.060 ! R2O2. OHA1 0.041 ! HCHO OHA2 0.034 ! CCHO OHA3 0.210 ! RCHO OHK3 0.024 ! ACET OHK4 0.007 ! MEK OHK6 0.490 ! PROD2 OHXC 3.550 ! C bal. calc. ! OH reaction generated Fri Mar 16 09:51:05 2001 PST ! 26DM-C8 : CH3-CH(CH3)-CH2-CH2-CH2-CH(CH3)-CH2-CH3 ! K(OH) 1.290e-11 ! kOH for T=298 only. ! kOH from: Carter et al (report in preparation, 1999) OHRR 0.567 ! RO2-R. OHNR 0.433 ! RO2-N. OHR2 1.096 ! R2O2. OHA1 0.000 ! HCHO OHA2 0.108 ! CCHO OHA3 0.308 ! RCHO OHK3 0.145 ! ACET OHK4 0.071 ! MEK OHK6 0.276 ! PROD2 OHXC 3.887 ! C bal. calc. ! OH reaction generated Fri Mar 16 09:51:41 2001 PST ! 2-ME-C9 : CH3-CH(CH3)-CH2-CH2-CH2-CH2-CH2-CH2-CH3 ! K(OH) 1.280e-11 ! kOH for T=298 only. ! kOH from: Carter et al (report in preparation, 1999) OHRR 0.551 ! RO2-R. OHNR 0.449 ! RO2-N. OHR2 0.895 ! R2O2. OHA3 0.035 ! RCHO OHK3 0.012 ! ACET OHK6 0.516 ! PROD2 OHXC 4.066 ! C bal. calc. ! OH reaction generated Fri Mar 16 09:51:59 2001 PST ! 34-DE-C6 : CH3-CH2-CH(CH2-CH3)-CH(CH2-CH3)-CH2-CH3 ! K(OH) 7.400e-12 ! kOH for T=298 only. ! kOH from: Atkinson et al, paper in preparation (1999) OHRR 0.619 ! RO2-R. OHNR 0.381 ! RO2-N. OHR2 1.105 ! R2O2. OHA1 0.007 ! HCHO OHA2 0.337 ! CCHO OHA3 0.319 ! RCHO OHK4 0.709 ! MEK OHK6 0.126 ! PROD2 OHXC 2.483 ! C bal. calc. ! OH reaction generated Fri Mar 16 09:53:50 2001 PST ! 3-ME-C9 : CH3-CH2-CH(CH3)-CH2-CH2-CH2-CH2-CH2-CH3 ! K(OH) 1.143e-11 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.551 ! RO2-R. OHNR 0.449 ! RO2-N. OHR2 0.928 ! R2O2. OHA1 0.000 ! HCHO OHA2 0.036 ! CCHO OHA3 0.063 ! RCHO OHK4 0.014 ! MEK OHK6 0.502 ! PROD2 OHXC 3.977 ! C bal. calc. ! OH reaction generated Fri Mar 16 09:54:30 2001 PST ! 4-ME-C9 : CH3-CH2-CH2-CH(CH3)-CH2-CH2-CH2-CH2-CH3 ! K(OH) 1.143e-11 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.572 ! RO2-R. OHNR 0.428 ! RO2-N. OHR2 0.876 ! R2O2. OHA1 0.001 ! HCHO OHA2 0.019 ! CCHO OHA3 0.140 ! RCHO OHK4 0.004 ! MEK OHK6 0.520 ! PROD2 OHXC 3.831 ! C bal. calc. ! OH reaction generated Fri Mar 16 09:55:17 2001 PST ! 4-PR-C7 : CH3-CH2-CH2-CH(CH2-CH2-CH3)-CH2-CH2-CH3 ! K(OH) 1.184e-11 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.593 ! RO2-R. OHNR 0.407 ! RO2-N. OHR2 0.834 ! R2O2. OHA1 0.001 ! HCHO OHA2 0.001 ! CCHO OHA3 0.296 ! RCHO OHK6 0.461 ! PROD2 OHXC 3.899 ! C bal. calc. ! OH reaction generated Fri Mar 16 09:55:37 2001 PST ! 26DM-C9 : CH3-CH(CH3)-CH2-CH2-CH2-CH(CH3)-CH2-CH2-CH3 ! K(OH) 1.283e-11 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.533 ! RO2-R. OHNR 0.467 ! RO2-N. OHR2 1.036 ! R2O2. OHA1 0.000 ! HCHO OHA2 0.001 ! CCHO OHA3 0.221 ! RCHO OHK3 0.120 ! ACET OHK4 0.006 ! MEK OHK6 0.376 ! PROD2 OHXC 4.888 ! C bal. calc. ! OH reaction generated Fri Mar 16 09:56:26 2001 PST ! 35-DE-C7 : CH3-CH2-CH(CH2-CH3)-CH2-CH(CH2-CH3)-CH2-CH3 ! K(OH) 1.392e-11 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.465 ! RO2-R. OHNR 0.535 ! RO2-N. OHR2 1.311 ! R2O2. OHA1 0.002 ! HCHO OHA2 0.475 ! CCHO OHA3 0.123 ! RCHO OHK4 0.044 ! MEK OHK6 0.371 ! PROD2 OHXC 4.064 ! C bal. calc. ! OH reaction generated Fri Mar 16 09:57:37 2001 PST ! 3-ME-C10 : CH3-CH2-CH(CH3)-CH2-CH2-CH2-CH2-CH2-CH2-CH3 ! K(OH) 1.285e-11 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.526 ! RO2-R. OHNR 0.474 ! RO2-N. OHR2 0.917 ! R2O2. OHA1 0.000 ! HCHO OHA2 0.029 ! CCHO OHA3 0.038 ! RCHO OHK4 0.012 ! MEK OHK6 0.489 ! PROD2 OHXC 4.998 ! C bal. calc. ! OH reaction generated Fri Mar 16 09:58:25 2001 PST ! 4-ME-C10 : CH3-CH2-CH2-CH(CH3)-CH2-CH2-CH2-CH2-CH2-CH3 ! K(OH) 1.285e-11 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.531 ! RO2-R. OHNR 0.469 ! RO2-N. OHR2 0.907 ! R2O2. OHA1 0.000 ! HCHO OHA2 0.001 ! CCHO OHA3 0.080 ! RCHO OHK4 0.003 ! MEK OHK6 0.500 ! PROD2 OHXC 4.932 ! C bal. calc. ! OH reaction generated Fri Mar 16 09:59:25 2001 PST ! 36-DE-C8 : CH3-CH2-CH(CH2-CH3)-CH2-CH2-CH(CH2-CH3)-CH2-CH3 ! K(OH) 1.534e-11 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.518 ! RO2-R. OHNR 0.482 ! RO2-N. OHR2 1.155 ! R2O2. OHA1 0.000 ! HCHO OHA2 0.301 ! CCHO OHA3 0.058 ! RCHO OHK4 0.108 ! MEK OHK6 0.473 ! PROD2 OHXC 5.062 ! C bal. calc. ! OH reaction generated Fri Mar 16 10:00:26 2001 PST ! 36DM-C10 : CH3-CH2-CH(CH3)-CH2-CH2-CH(CH3)-CH2-CH2-CH2-CH3 ! K(OH) 1.453e-11 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.494 ! RO2-R. OHNR 0.506 ! RO2-N. OHR2 1.079 ! R2O2. OHA1 0.001 ! HCHO OHA2 0.088 ! CCHO OHA3 0.110 ! RCHO OHK4 0.055 ! MEK OHK6 0.458 ! PROD2 OHXC 5.488 ! C bal. calc. ! OH reaction generated Fri Mar 16 10:02:16 2001 PST ! 3-ME-C11 : CH3-CH2-CH(CH3)-CH2-CH2-CH2-CH2-CH2-CH2-CH2-CH3 ! K(OH) 1.427e-11 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.516 ! RO2-R. OHNR 0.484 ! RO2-N. OHR2 0.896 ! R2O2. OHA1 0.000 ! HCHO OHA2 0.025 ! CCHO OHA3 0.033 ! RCHO OHK4 0.011 ! MEK OHK6 0.484 ! PROD2 OHXC 5.997 ! C bal. calc. ! OH reaction generated Fri Mar 16 10:03:18 2001 PST ! 5-ME-C11 : CH3-CH2-CH2-CH2-CH(CH3)-CH2-CH2-CH2-CH2-CH2-CH3 ! K(OH) 1.427e-11 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.524 ! RO2-R. OHNR 0.476 ! RO2-N. OHR2 0.867 ! R2O2. OHA1 0.000 ! HCHO OHA2 0.010 ! CCHO OHA3 0.059 ! RCHO OHK6 0.504 ! PROD2 OHXC 5.923 ! C bal. calc. ! OH reaction generated Fri Mar 16 10:04:43 2001 PST ! 36DM-C11 : CH3-CH2-CH(CH3)-CH2-CH2-CH(CH3)-CH2-CH2-CH2-CH2-CH3 ! K(OH) 1.595e-11 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.488 ! RO2-R. OHNR 0.512 ! RO2-N. OHR2 1.046 ! R2O2. OHA1 0.001 ! HCHO OHA2 0.070 ! CCHO OHA3 0.124 ! RCHO OHK4 0.046 ! MEK OHK6 0.442 ! PROD2 OHXC 6.579 ! C bal. calc. ! OH reaction generated Fri Mar 16 10:06:53 2001 PST ! 37-DE-C9 : CH3-CH2-CH(CH2-CH3)-CH2-CH2-CH2-CH(CH2-CH3)-CH2-CH3 ! K(OH) 1.676e-11 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.500 ! RO2-R. OHNR 0.500 ! RO2-N. OHR2 1.107 ! R2O2. OHA1 0.000 ! HCHO OHA2 0.132 ! CCHO OHA3 0.293 ! RCHO OHK4 0.105 ! MEK OHK6 0.304 ! PROD2 OHXC 6.607 ! C bal. calc. ! OH reaction generated Fri Mar 16 10:08:21 2001 PST ! 3-ME-C12 : CH3-CH2-CH(CH3)-CH2-CH2-CH2-CH2-CH2-CH2-CH2-CH2-CH3 ! K(OH) 1.569e-11 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.510 ! RO2-R. OHNR 0.490 ! RO2-N. OHR2 0.880 ! R2O2. OHA1 0.000 ! HCHO OHA2 0.023 ! CCHO OHA3 0.030 ! RCHO OHK4 0.009 ! MEK OHK6 0.482 ! PROD2 OHXC 6.997 ! C bal. calc. ! OH reaction generated Fri Mar 16 10:09:39 2001 PST ! 5-ME-C12 : CH3-CH2-CH2-CH2-CH(CH3)-CH2-CH2-CH2-CH2-CH2-CH2-CH3 ! K(OH) 1.569e-11 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.514 ! RO2-R. OHNR 0.486 ! RO2-N. OHR2 0.863 ! R2O2. OHA1 0.000 ! HCHO OHA2 0.009 ! CCHO OHA3 0.044 ! RCHO OHK6 0.498 ! PROD2 OHXC 6.942 ! C bal. calc. ! OH reaction generated Fri Mar 16 10:11:11 2001 PST ! 37DM-C12 : CH3-CH2-CH(CH3)-CH2-CH2-CH2-CH(CH3)-CH2-CH2-CH2-CH2-CH3 ! K(OH) 1.737e-11 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.496 ! RO2-R. OHNR 0.504 ! RO2-N. OHR2 0.980 ! R2O2. OHA1 0.000 ! HCHO OHA2 0.055 ! CCHO OHA3 0.110 ! RCHO OHK4 0.030 ! MEK OHK6 0.440 ! PROD2 OHXC 7.772 ! C bal. calc. ! OH reaction generated Fri Mar 16 10:12:52 2001 PST ! 38DE-C10 : CH3-CH2-CH(CH2-CH3)-CH2-CH2-CH2-CH2-CH(CH2-CH3)-CH2-CH3 ! K(OH) 1.818e-11 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.471 ! RO2-R. OHNR 0.529 ! RO2-N. OHR2 1.030 ! R2O2. OHA1 0.000 ! HCHO OHA2 0.066 ! CCHO OHA3 0.057 ! RCHO OHK4 0.017 ! MEK OHK6 0.428 ! PROD2 OHXC 7.885 ! C bal. calc. ! OH reaction generated Fri Mar 16 10:14:33 2001 PST ! 3-ME-C13 : CH3-CH2-CH(CH3)-CH2-CH2-CH2-CH2-CH2-CH2-CH2-CH2-CH2-CH3 ! K(OH) 1.711e-11 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.506 ! RO2-R. OHNR 0.494 ! RO2-N. OHR2 0.871 ! R2O2. OHA2 0.021 ! CCHO OHA3 0.015 ! RCHO OHK4 0.009 ! MEK OHK6 0.493 ! PROD2 OHXC 7.958 ! C bal. calc. ! OH reaction generated Fri Mar 16 10:15:35 2001 PST ! 6-ME-C13 : CH3-CH2-CH2-CH2-CH2-CH(CH3)-CH2-CH2-CH2-CH2-CH2-CH2-CH3 ! K(OH) 1.711e-11 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.512 ! RO2-R. OHNR 0.488 ! RO2-N. OHR2 0.852 ! R2O2. OHA1 0.000 ! HCHO OHA2 0.006 ! CCHO OHA3 0.041 ! RCHO OHK6 0.504 ! PROD2 OHXC 7.909 ! C bal. calc. ! OH reaction generated Fri Mar 16 10:17:01 2001 PST ! 37DM-C13 : CH3-CH2-CH(CH3)-CH2-CH2-CH2-CH(CH3)-CH2-CH2-CH2-CH2-CH2-CH3 ! K(OH) 1.879e-11 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.487 ! RO2-R. OHNR 0.513 ! RO2-N. OHR2 0.980 ! R2O2. OHA1 0.000 ! HCHO OHA2 0.045 ! CCHO OHA3 0.087 ! RCHO OHK4 0.028 ! MEK OHK6 0.440 ! PROD2 OHXC 8.820 ! C bal. calc. ! OH reaction generated Fri Mar 16 10:19:05 2001 PST ! 39DE-C11 : CH3-CH2-CH(CH2-CH3)-CH2-CH2-CH2-CH2-CH2-CH(CH2-CH3)-CH2-CH3 ! K(OH) 1.960e-11 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.474 ! RO2-R. OHNR 0.526 ! RO2-N. OHR2 0.997 ! R2O2. OHA1 0.000 ! HCHO OHA2 0.058 ! CCHO OHA3 0.051 ! RCHO OHK4 0.016 ! MEK OHK6 0.435 ! PROD2 OHXC 8.899 ! C bal. calc. ! OH reaction generated Fri Mar 16 10:21:00 2001 PST ! 3-ME-C14 : CH3-CH2-CH(CH3)-CH2-CH2-CH2-CH2-CH2-CH2-CH2-CH2-CH2-CH2-CH3 ! K(OH) 1.853e-11 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.505 ! RO2-R. OHNR 0.495 ! RO2-N. OHR2 0.861 ! R2O2. OHA2 0.020 ! CCHO OHA3 0.013 ! RCHO OHK4 0.008 ! MEK OHK6 0.493 ! PROD2 OHXC 8.961 ! C bal. calc. ! OH reaction generated Fri Mar 16 10:22:18 2001 PST ! 6-ME-C14 : CH3-CH2-CH2-CH2-CH2-CH(CH3)-CH2-CH2-CH2-CH2-CH2-CH2-CH2-CH3 ! K(OH) 1.853e-11 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.510 ! RO2-R. OHNR 0.490 ! RO2-N. OHR2 0.843 ! R2O2. OHA1 0.000 ! HCHO OHA2 0.006 ! CCHO OHA3 0.037 ! RCHO OHK6 0.503 ! PROD2 OHXC 8.918 ! C bal. calc. ! OH reaction generated Fri Mar 16 10:24:02 2001 PST ! 3-ME-C15 : CH3-CH2-CH(CH3)-CH2-CH2-CH2-CH2-CH2-CH2-CH2-CH2-CH2-CH2-CH2-CH3 ! K(OH) 1.996e-11 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.504 ! RO2-R. OHNR 0.496 ! RO2-N. OHR2 0.853 ! R2O2. OHA2 0.018 ! CCHO OHA3 0.012 ! RCHO OHK4 0.008 ! MEK OHK6 0.493 ! PROD2 OHXC 9.964 ! C bal. calc. ! OH reaction generated Fri Mar 16 10:25:45 2001 PST ! 48DM-C14 : CH3-CH2-CH2-CH(CH3)-CH2-CH2-CH2-CH(CH3)-CH2-CH2-CH2-CH2-CH2-CH3 ! K(OH) 2.021e-11 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.481 ! RO2-R. OHNR 0.519 ! RO2-N. OHR2 0.962 ! R2O2. OHA1 0.000 ! HCHO OHA2 0.001 ! CCHO OHA3 0.071 ! RCHO OHK4 0.003 ! MEK OHK6 0.473 ! PROD2 OHXC 9.820 ! C bal. calc. ! OH reaction generated Fri Mar 16 10:28:49 2001 PST ! 7-ME-C15 : CH3-CH2-CH2-CH2-CH2-CH2-CH(CH3)-CH2-CH2-CH2-CH2-CH2-CH2-CH2-CH3 ! K(OH) 1.996e-11 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.503 ! RO2-R. OHNR 0.497 ! RO2-N. OHR2 0.853 ! R2O2. OHA1 0.000 ! HCHO OHA2 0.000 ! CCHO OHA3 0.022 ! RCHO OHK6 0.500 ! PROD2 OHXC 9.950 ! C bal. calc. ! OH reaction generated Fri Mar 16 10:30:57 2001 PST ! CYCC3 : *CH2-CH2-CH2-* ! K(OH) 8.400e-14 ! kOH for T=298 only. ! kOH from: Atkinson (1997a) OHRR 0.949 ! RO2-R. OHNR 0.051 ! RO2-N. OHR2 0.949 ! R2O2. OHA3 0.949 ! RCHO OHXC -0.153 ! C bal. calc. ! OH reaction generated Fri Mar 16 10:30:58 2001 PST ! CYCC4 : *CH2-CH2-CH2-CH2-* ! K(OH) 1.500e-12 ! kOH for T=298 only. ! kOH from: Atkinson (1997a) OHNR 0.117 ! RO2-N. OHR2 1.803 ! R2O2. OHQ2 0.883 ! RCO-O2. OHXC 0.650 ! C bal. calc. ! OH reaction generated Fri Mar 16 10:30:59 2001 PST ! CYCC5 : *CH2-CH2-CH2-CH2-CH2-* ! K(OH) 2.310e-12 -0.467 2.00 ! kOH from: Atkinson (1997a) OHRR 0.776 ! RO2-R. OHNR 0.224 ! RO2-N. OHR2 1.661 ! R2O2. OHCO 0.054 ! CO OHA3 0.756 ! RCHO OHK4 0.020 ! MEK OHXC 1.255 ! C bal. calc. ! OH reaction generated Fri Mar 16 10:31:01 2001 PST ! CYCC6 : *CH2-CH2-CH2-CH2-CH2-CH2-* ! K(OH) 2.590e-12 -0.614 2.00 ! kOH from: Atkinson (1997a) OHRR 0.799 ! RO2-R. OHNR 0.201 ! RO2-N. OHR2 0.473 ! R2O2. OHA3 0.203 ! RCHO OHK6 0.597 ! PROD2 OHXC 0.608 ! C bal. calc. ! OH reaction generated Fri Mar 16 10:31:02 2001 PST ! IPR-CC3 : *CH(CH(CH3)-CH3)-CH2-CH2-* ! K(OH) 2.700e-12 ! kOH for T=298 only. ! kOH from: Atkinson (1997a) OHRR 0.833 ! RO2-R. OHNR 0.164 ! RO2-N. OHR2 1.821 ! R2O2. OHQ2 0.002 ! RCO-O2. OHA1 0.087 ! HCHO OHA2 0.087 ! CCHO OHA3 0.835 ! RCHO OHK3 0.770 ! ACET OHXX 0.000 ! INERT OHXC -0.068 ! C bal. calc. ! OH reaction generated Fri Mar 16 10:31:08 2001 PST ! ME-CYCC5 : *CH(CH3)-CH2-CH2-CH2-CH2-* ! K(OH) 5.681e-12 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.453 ! RO2-R. OHNR 0.306 ! RO2-N. OHR2 1.847 ! R2O2. OHQ1 0.239 ! CCO-O2. OHQ2 0.003 ! RCO-O2. OHCO 0.023 ! CO OHA1 0.017 ! HCHO OHA3 0.689 ! RCHO OHK4 0.000 ! MEK OHK6 0.003 ! PROD2 OHXC 1.556 ! C bal. calc. ! OH reaction generated Fri Mar 16 10:31:15 2001 PST ! 13DMCYC5 : *CH(CH3)-CH2-CH(CH3)-CH2-CH2-* ! K(OH) 6.818e-12 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.275 ! RO2-R. OHNR 0.381 ! RO2-N. OHR2 1.873 ! R2O2. OHQ1 0.344 ! CCO-O2. OHQ2 0.001 ! RCO-O2. OHCO 0.037 ! CO OHA1 0.028 ! HCHO OHA2 0.002 ! CCHO OHA3 0.584 ! RCHO OHK6 0.035 ! PROD2 OHXC 1.999 ! C bal. calc. ! OH reaction generated Fri Mar 16 10:31:29 2001 PST ! CYCC7 : *CH2-CH2-CH2-CH2-CH2-CH2-CH2-* ! K(OH) 1.300e-11 ! kOH for T=298 only. ! kOH from: Atkinson (1997a) OHRR 0.509 ! RO2-R. OHNR 0.390 ! RO2-N. OHR2 1.578 ! R2O2. OHQ2 0.101 ! RCO-O2. OHA3 0.492 ! RCHO OHK6 0.017 ! PROD2 OHXC 2.778 ! C bal. calc. ! OH reaction generated Fri Mar 16 10:31:31 2001 PST ! ET-CYCC5 : *CH(CH2-CH3)-CH2-CH2-CH2-CH2-* ! K(OH) 7.265e-12 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.404 ! RO2-R. OHNR 0.389 ! RO2-N. OHR2 1.860 ! R2O2. OHQ2 0.208 ! RCO-O2. OHCO 0.019 ! CO OHA1 0.007 ! HCHO OHA2 0.132 ! CCHO OHA3 0.590 ! RCHO OHK4 0.003 ! MEK OHK6 0.004 ! PROD2 OHGL 0.000 ! GLY OHMG 0.010 ! MGLY OHXC 1.922 ! C bal. calc. ! OH reaction generated Fri Mar 16 10:31:45 2001 PST ! ME-CYCC6 : *CH(CH3)-CH2-CH2-CH2-CH2-CH2-* ! K(OH) 1.000e-11 ! kOH for T=298 only. ! kOH from: Atkinson (1997a) OHRR 0.660 ! RO2-R. OHNR 0.340 ! RO2-N. OHR2 1.146 ! R2O2. OHQ2 0.000 ! RCO-O2. OHCO 0.000 ! CO OHA1 0.011 ! HCHO OHA2 0.002 ! CCHO OHA3 0.455 ! RCHO OHK6 0.208 ! PROD2 OHMG 0.000 ! MGLY OHXC 2.328 ! C bal. calc. ! OH reaction generated Fri Mar 16 10:31:56 2001 PST ! 13DMCYC6 : *CH(CH3)-CH2-CH(CH3)-CH2-CH2-CH2-* ! K(OH) 1.188e-11 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.553 ! RO2-R. OHNR 0.445 ! RO2-N. OHR2 1.397 ! R2O2. OHQ1 0.001 ! CCO-O2. OHCO 0.009 ! CO OHA1 0.020 ! HCHO OHA2 0.014 ! CCHO OHA3 0.509 ! RCHO OHK4 0.001 ! MEK OHK6 0.059 ! PROD2 OHMG 0.000 ! MGLY OHXC 3.389 ! C bal. calc. ! OH reaction generated Fri Mar 16 10:32:15 2001 PST ! CYCC8 : *CH2-CH2-CH2-CH2-CH2-CH2-CH2-CH2-* ! K(OH) 1.400e-11 ! kOH for T=298 only. ! kOH from: Atkinson (1997a) OHRR 0.525 ! RO2-R. OHNR 0.475 ! RO2-N. OHR2 1.475 ! R2O2. OHCO 0.001 ! CO OHA3 0.525 ! RCHO OHXC 3.573 ! C bal. calc. ! OH reaction generated Fri Mar 16 10:32:18 2001 PST ! ET-CYCC6 : *CH(CH2-CH3)-CH2-CH2-CH2-CH2-CH2-* ! K(OH) 1.203e-11 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.624 ! RO2-R. OHNR 0.376 ! RO2-N. OHR2 1.046 ! R2O2. OHQ2 0.000 ! RCO-O2. OHCO 0.000 ! CO OHA1 0.002 ! HCHO OHA2 0.151 ! CCHO OHA3 0.328 ! RCHO OHK6 0.299 ! PROD2 OHMG 0.000 ! MGLY OHXC 2.662 ! C bal. calc. ! OH reaction generated Fri Mar 16 10:32:40 2001 PST ! PR-CYCC5 : *CH(CH2-CH2-CH3)-CH2-CH2-CH2-CH2-* ! K(OH) 8.685e-12 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.390 ! RO2-R. OHNR 0.458 ! RO2-N. OHR2 1.739 ! R2O2. OHQ2 0.152 ! RCO-O2. OHCO 0.013 ! CO OHA1 0.007 ! HCHO OHA2 0.001 ! CCHO OHA3 0.638 ! RCHO OHK4 0.002 ! MEK OHK6 0.027 ! PROD2 OHGL 0.000 ! GLY OHMG 0.005 ! MGLY OHXC 2.677 ! C bal. calc. ! OH reaction generated Fri Mar 16 10:33:06 2001 PST ! 113MCYC6 : *C(CH3)(CH3)-CH2-CH(CH3)-CH2-CH2-CH2-* ! K(OH) 8.700e-12 ! kOH for T=298 only. ! kOH from: Atkinson (1997a) OHRR 0.484 ! RO2-R. OHNR 0.512 ! RO2-N. OHR2 1.581 ! R2O2. OHQ1 0.004 ! CCO-O2. OHQ2 0.000 ! RCO-O2. OHCO 0.073 ! CO OHA1 0.132 ! HCHO OHA2 0.107 ! CCHO OHA3 0.473 ! RCHO OHK3 0.042 ! ACET OHK4 0.005 ! MEK OHK6 0.103 ! PROD2 OHGL 0.000 ! GLY OHMG 0.000 ! MGLY OHXC 3.318 ! C bal. calc. ! OH reaction generated Fri Mar 16 10:33:53 2001 PST ! 1E4MCYC6 : *CH(CH2-CH3)-CH2-CH2-CH(CH3)-CH2-CH2-* ! K(OH) 1.371e-11 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.518 ! RO2-R. OHNR 0.481 ! RO2-N. OHR2 1.339 ! R2O2. OHQ1 0.001 ! CCO-O2. OHQ2 0.000 ! RCO-O2. OHCO 0.000 ! CO OHA1 0.033 ! HCHO OHA2 0.142 ! CCHO OHA3 0.411 ! RCHO OHK6 0.143 ! PROD2 OHMG 0.000 ! MGLY OHXC 3.703 ! C bal. calc. ! OH reaction generated Fri Mar 16 10:34:27 2001 PST ! C3-CYCC6 : *CH(CH2-CH2-CH3)-CH2-CH2-CH2-CH2-CH2-* ! K(OH) 1.345e-11 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.610 ! RO2-R. OHNR 0.389 ! RO2-N. OHR2 0.864 ! R2O2. OHQ2 0.001 ! RCO-O2. OHCO 0.000 ! CO OHA1 0.001 ! HCHO OHA2 0.000 ! CCHO OHA3 0.363 ! RCHO OHK6 0.388 ! PROD2 OHGL 0.000 ! GLY OHMG 0.000 ! MGLY OHXC 3.242 ! C bal. calc. ! OH reaction generated Fri Mar 16 10:35:07 2001 PST ! 13DECYC6 : *CH(CH2-CH3)-CH2-CH(CH2-CH3)-CH2-CH2-CH2-* ! K(OH) 1.553e-11 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.490 ! RO2-R. OHNR 0.510 ! RO2-N. OHR2 1.249 ! R2O2. OHQ2 0.000 ! RCO-O2. OHCO 0.004 ! CO OHA1 0.002 ! HCHO OHA2 0.176 ! CCHO OHA3 0.334 ! RCHO OHK4 0.001 ! MEK OHK6 0.165 ! PROD2 OHGL 0.000 ! GLY OHMG 0.000 ! MGLY OHXC 4.582 ! C bal. calc. ! OH reaction generated Fri Mar 16 10:36:31 2001 PST ! 14DECYC6 : *CH(CH2-CH3)-CH2-CH2-CH(CH2-CH3)-CH2-CH2-* ! K(OH) 1.553e-11 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.508 ! RO2-R. OHNR 0.490 ! RO2-N. OHR2 1.229 ! R2O2. OHQ2 0.002 ! RCO-O2. OHCO 0.000 ! CO OHA1 0.021 ! HCHO OHA2 0.226 ! CCHO OHA3 0.333 ! RCHO OHK6 0.209 ! PROD2 OHMG 0.000 ! MGLY OHXC 4.328 ! C bal. calc. ! OH reaction generated Fri Mar 16 10:37:00 2001 PST ! 1M3IPCY6 : *CH(CH(CH3)-CH3)-CH2-CH(CH3)-CH2-CH2-CH2-* ! K(OH) 1.510e-11 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.535 ! RO2-R. OHNR 0.460 ! RO2-N. OHR2 1.204 ! R2O2. OHQ1 0.000 ! CCO-O2. OHQ2 0.004 ! RCO-O2. OHCO 0.006 ! CO OHA1 0.008 ! HCHO OHA2 0.005 ! CCHO OHA3 0.263 ! RCHO OHK3 0.339 ! ACET OHK4 0.000 ! MEK OHK6 0.293 ! PROD2 OHGL 0.000 ! GLY OHMG 0.000 ! MGLY OHXC 3.634 ! C bal. calc. ! OH reaction generated Fri Mar 16 10:38:27 2001 PST ! C4-CYCC6 : *CH(CH2-CH2-CH2-CH3)-CH2-CH2-CH2-CH2-CH2-* ! K(OH) 1.487e-11 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.576 ! RO2-R. OHNR 0.423 ! RO2-N. OHR2 0.827 ! R2O2. OHQ2 0.000 ! RCO-O2. OHCO 0.000 ! CO OHA1 0.000 ! HCHO OHA2 0.024 ! CCHO OHA3 0.179 ! RCHO OHK6 0.467 ! PROD2 OHGL 0.000 ! GLY OHMG 0.000 ! MGLY OHXC 4.070 ! C bal. calc. ! OH reaction generated Fri Mar 16 10:39:21 2001 PST ! 13E5MCC6 : *CH(CH2-CH3)-CH2-CH(CH2-CH3)-CH2-CH(CH3)-CH2-* ! K(OH) 1.721e-11 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.429 ! RO2-R. OHNR 0.566 ! RO2-N. OHR2 1.371 ! R2O2. OHQ1 0.003 ! CCO-O2. OHQ2 0.002 ! RCO-O2. OHCO 0.006 ! CO OHA1 0.020 ! HCHO OHA2 0.168 ! CCHO OHA3 0.355 ! RCHO OHK4 0.009 ! MEK OHK6 0.090 ! PROD2 OHGL 0.000 ! GLY OHMG 0.000 ! MGLY OHXC 5.587 ! C bal. calc. ! OH reaction generated Fri Mar 16 10:41:11 2001 PST ! 1E2PCYC6 : *CH(CH2-CH3)-CH(CH2-CH2-CH3)-CH2-CH2-CH2-CH2-* ! K(OH) 1.695e-11 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.461 ! RO2-R. OHNR 0.539 ! RO2-N. OHR2 1.199 ! R2O2. OHQ2 0.001 ! RCO-O2. OHCO 0.000 ! CO OHA1 0.007 ! HCHO OHA2 0.031 ! CCHO OHA3 0.186 ! RCHO OHK4 0.000 ! MEK OHK6 0.349 ! PROD2 OHGL 0.000 ! GLY OHMG 0.000 ! MGLY OHXC 5.045 ! C bal. calc. ! OH reaction generated Fri Mar 16 10:46:34 2001 PST ! C5-CYCC6 : *CH(CH2-CH2-CH2-CH2-CH3)-CH2-CH2-CH2-CH2-CH2-* ! K(OH) 1.629e-11 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.557 ! RO2-R. OHNR 0.443 ! RO2-N. OHR2 0.808 ! R2O2. OHQ2 0.000 ! RCO-O2. OHCO 0.000 ! CO OHA1 0.000 ! HCHO OHA2 0.016 ! CCHO OHA3 0.147 ! RCHO OHK6 0.456 ! PROD2 OHGL 0.000 ! GLY OHMG 0.000 ! MGLY OHXC 5.135 ! C bal. calc. ! OH reaction generated Fri Mar 16 10:47:42 2001 PST ! 135ECYC6 : *CH(CH2-CH3)-CH2-CH(CH2-CH3)-CH2-CH(CH2-CH3)-CH2-* ! K(OH) 1.904e-11 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.417 ! RO2-R. OHNR 0.580 ! RO2-N. OHR2 1.353 ! R2O2. OHQ2 0.003 ! RCO-O2. OHCO 0.005 ! CO OHA1 0.014 ! HCHO OHA2 0.221 ! CCHO OHA3 0.315 ! RCHO OHK4 0.008 ! MEK OHK6 0.116 ! PROD2 OHGL 0.000 ! GLY OHMG 0.000 ! MGLY OHXC 6.373 ! C bal. calc. ! OH reaction generated Fri Mar 16 10:49:07 2001 PST ! 1M4C5CY6 : *CH(CH2-CH2-CH2-CH2-CH3)-CH2-CH2-CH(CH3)-CH2-CH2-* ! K(OH) 1.797e-11 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.482 ! RO2-R. OHNR 0.518 ! RO2-N. OHR2 1.049 ! R2O2. OHQ1 0.001 ! CCO-O2. OHQ2 0.000 ! RCO-O2. OHCO 0.000 ! CO OHA1 0.001 ! HCHO OHA2 0.015 ! CCHO OHA3 0.210 ! RCHO OHK6 0.326 ! PROD2 OHGL 0.000 ! GLY OHMG 0.000 ! MGLY OHXC 6.274 ! C bal. calc. ! OH reaction generated Fri Mar 16 10:50:12 2001 PST ! C6-CYCC6 : *CH(CH2-CH2-CH2-CH2-CH2-CH3)-CH2-CH2-CH2-CH2-CH2-* ! K(OH) 1.780e-11 ! kOH for T=298 only. ! kOH from: Carter et al (report in preparation, 1998) OHRR 0.527 ! RO2-R. OHNR 0.473 ! RO2-N. OHR2 0.849 ! R2O2. OHQ2 0.000 ! RCO-O2. OHCO 0.000 ! CO OHA1 0.000 ! HCHO OHA2 0.000 ! CCHO OHA3 0.093 ! RCHO OHK6 0.461 ! PROD2 OHGL 0.000 ! GLY OHMG 0.000 ! MGLY OHXC 6.118 ! C bal. calc. ! OH reaction generated Fri Mar 16 10:51:35 2001 PST ! 13E5PCC6 : *CH(CH2-CH3)-CH2-CH(CH2-CH3)-CH2-CH(CH2-CH2-CH3)-CH2-* ! K(OH) 2.046e-11 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.433 ! RO2-R. OHNR 0.564 ! RO2-N. OHR2 1.237 ! R2O2. OHQ2 0.003 ! RCO-O2. OHCO 0.002 ! CO OHA1 0.010 ! HCHO OHA2 0.132 ! CCHO OHA3 0.342 ! RCHO OHK4 0.002 ! MEK OHK6 0.188 ! PROD2 OHGL 0.000 ! GLY OHMG 0.000 ! MGLY OHXC 7.163 ! C bal. calc. ! OH reaction generated Fri Mar 16 10:59:55 2001 PST ! 1M2C6CC6 : *CH(CH2-CH2-CH2-CH2-CH2-CH3)-CH(CH3)-CH2-CH2-CH2-CH2-* ! K(OH) 1.939e-11 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.462 ! RO2-R. OHNR 0.537 ! RO2-N. OHR2 1.080 ! R2O2. OHQ2 0.001 ! RCO-O2. OHCO 0.000 ! CO OHA1 0.004 ! HCHO OHA2 0.009 ! CCHO OHA3 0.128 ! RCHO OHK4 0.000 ! MEK OHK6 0.380 ! PROD2 OHGL 0.000 ! GLY OHMG 0.000 ! MGLY OHXC 7.092 ! C bal. calc. ! OH reaction generated Fri Mar 16 11:04:11 2001 PST ! C7-CYCC6 : *CH(CH2-CH2-CH2-CH2-CH2-CH2-CH3)-CH2-CH2-CH2-CH2-CH2-* ! K(OH) 1.913e-11 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.515 ! RO2-R. OHNR 0.485 ! RO2-N. OHR2 0.855 ! R2O2. OHQ2 0.000 ! RCO-O2. OHCO 0.000 ! CO OHA1 0.000 ! HCHO OHA2 0.000 ! CCHO OHA3 0.069 ! RCHO OHK6 0.462 ! PROD2 OHGL 0.000 ! GLY OHMG 0.000 ! MGLY OHXC 7.108 ! C bal. calc. ! OH reaction generated Fri Mar 16 11:05:47 2001 PST ! 13P5ECC6 : *CH(CH2-CH2-CH3)-CH2-CH(CH2-CH2-CH3)-CH2-CH(CH2-CH3)-CH2-* ! K(OH) 2.188e-11 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.445 ! RO2-R. OHNR 0.553 ! RO2-N. OHR2 1.158 ! R2O2. OHQ2 0.002 ! RCO-O2. OHCO 0.001 ! CO OHA1 0.007 ! HCHO OHA2 0.060 ! CCHO OHA3 0.376 ! RCHO OHK6 0.234 ! PROD2 OHGL 0.000 ! GLY OHMG 0.000 ! MGLY OHXC 8.017 ! C bal. calc. ! OH reaction generated Fri Mar 16 11:23:42 2001 PST ! 1M4C7CC6 : *CH(CH2-CH2-CH2-CH2-CH2-CH2-CH3)-CH2-CH2-CH(CH3)-CH2-CH2-* ! K(OH) 2.081e-11 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.455 ! RO2-R. OHNR 0.544 ! RO2-N. OHR2 1.059 ! R2O2. OHQ1 0.000 ! CCO-O2. OHQ2 0.000 ! RCO-O2. OHCO 0.000 ! CO OHA1 0.001 ! HCHO OHA2 0.000 ! CCHO OHA3 0.131 ! RCHO OHK6 0.349 ! PROD2 OHMG 0.000 ! MGLY OHXC 8.242 ! C bal. calc. ! OH reaction generated Fri Mar 16 11:25:15 2001 PST ! C8-CYCC6 : *CH(CH2-CH2-CH2-CH2-CH2-CH2-CH2-CH3)-CH2-CH2-CH2-CH2-CH2-* ! K(OH) 2.055e-11 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.511 ! RO2-R. OHNR 0.489 ! RO2-N. OHR2 0.847 ! R2O2. OHQ2 0.000 ! RCO-O2. OHCO 0.000 ! CO OHA1 0.000 ! HCHO OHA2 0.000 ! CCHO OHA3 0.063 ! RCHO OHK6 0.463 ! PROD2 OHGL 0.000 ! GLY OHMG 0.000 ! MGLY OHXC 8.099 ! C bal. calc. ! OH reaction generated Fri Mar 16 11:27:08 2001 PST ! 135PCYC6 : *CH(CH2-CH2-CH3)-CH2-CH(CH2-CH2-CH3)-CH2-CH(CH2-CH2-CH3)-CH2-* ! K(OH) 2.330e-11 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.453 ! RO2-R. OHNR 0.545 ! RO2-N. OHR2 1.106 ! R2O2. OHQ2 0.002 ! RCO-O2. OHCO 0.001 ! CO OHA1 0.005 ! HCHO OHA2 0.000 ! CCHO OHA3 0.415 ! RCHO OHK6 0.258 ! PROD2 OHGL 0.000 ! GLY OHMG 0.000 ! MGLY OHXC 8.923 ! C bal. calc. ! OH reaction generated Fri Mar 16 11:40:25 2001 PST ! 1M2C8CC6 : *CH(CH2-CH2-CH2-CH2-CH2-CH2-CH2-CH3)-CH(CH3)-CH2-CH2-CH2-CH2-* ! K(OH) 2.223e-11 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.462 ! RO2-R. OHNR 0.538 ! RO2-N. OHR2 1.035 ! R2O2. OHQ2 0.000 ! RCO-O2. OHCO 0.000 ! CO OHA1 0.003 ! HCHO OHA2 0.008 ! CCHO OHA3 0.105 ! RCHO OHK4 0.000 ! MEK OHK6 0.394 ! PROD2 OHGL 0.000 ! GLY OHMG 0.000 ! MGLY OHXC 9.080 ! C bal. calc. ! OH reaction generated Fri Mar 16 11:46:01 2001 PST ! C9-CYCC6 : *CH(CH2-CH2-CH2-CH2-CH2-CH2-CH2-CH2-CH3)-CH2-CH2-CH2-CH2-CH2-* ! K(OH) 2.197e-11 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.509 ! RO2-R. OHNR 0.490 ! RO2-N. OHR2 0.838 ! R2O2. OHQ2 0.000 ! RCO-O2. OHCO 0.000 ! CO OHA1 0.000 ! HCHO OHA2 0.000 ! CCHO OHA3 0.058 ! RCHO OHK6 0.465 ! PROD2 OHGL 0.000 ! GLY OHMG 0.000 ! MGLY OHXC 9.091 ! C bal. calc. ! OH reaction generated Fri Mar 16 11:48:28 2001 PST ! 13P5BCC6 : *CH(CH2-CH2-CH3)-CH2-CH(CH2-CH2-CH3)-CH2-CH(CH2-CH2-CH2-CH3)-CH2-* ! K(OH) 2.472e-11 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.461 ! RO2-R. OHNR 0.538 ! RO2-N. OHR2 1.045 ! R2O2. OHQ2 0.001 ! RCO-O2. OHCO 0.001 ! CO OHA1 0.003 ! HCHO OHA2 0.013 ! CCHO OHA3 0.322 ! RCHO OHK6 0.318 ! PROD2 OHGL 0.000 ! GLY OHMG 0.000 ! MGLY OHXC 9.863 ! C bal. calc. ! OH reaction generated Fri Mar 16 12:27:17 2001 PST ! 1M4C9CY6 : *CH(CH2-CH2-CH2-CH2-CH2-CH2-CH2-CH2-CH3)-CH2-CH2-CH(CH3)-CH2-CH2-* ! K(OH) 2.365e-11 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.458 ! RO2-R. OHNR 0.541 ! RO2-N. OHR2 1.018 ! R2O2. OHQ1 0.000 ! CCO-O2. OHQ2 0.000 ! RCO-O2. OHCO 0.000 ! CO OHA1 0.001 ! HCHO OHA2 0.000 ! CCHO OHA3 0.113 ! RCHO OHK6 0.367 ! PROD2 OHMG 0.000 ! MGLY OHXC 10.209 ! C bal. calc. ! OH reaction generated Fri Mar 16 12:29:49 2001 PST ! C10CYCC6 : *CH(CH2-CH2-CH2-CH2-CH2-CH2-CH2-CH2-CH2-CH3)-CH2-CH2-CH2-CH2-CH2-* ! K(OH) 2.339e-11 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.508 ! RO2-R. OHNR 0.492 ! RO2-N. OHR2 0.834 ! R2O2. OHQ2 0.000 ! RCO-O2. OHCO 0.000 ! CO OHA1 0.000 ! HCHO OHA2 0.000 ! CCHO OHA3 0.055 ! RCHO OHK6 0.467 ! PROD2 OHGL 0.000 ! GLY OHMG 0.000 ! MGLY OHXC 10.085 ! C bal. calc. ! OH reaction generated Fri Mar 16 12:32:56 2001 PST ! MEOH : CH3-OH ! K(OH) 3.100e-12 0.715 0.00 ! kOH from: IUPAC (1999) OHRH 1.000 ! HO2. OHA1 1.000 ! HCHO ! OH reaction generated Fri Mar 16 12:40:54 2001 PST ! ETOH : CH3-CH2-OH ! K(OH) 5.560e-13 -1.057 0.00 ! kOH from: IUPAC (1999) OHRH 0.950 ! HO2. OHRR 0.050 ! RO2-R. OHA1 0.081 ! HCHO OHA2 0.960 ! CCHO OHXC -0.000 ! C bal. calc. ! OH reaction generated Fri Mar 16 12:40:55 2001 PST ! I-C3-OH : CH3-CH(OH)-CH3 ! K(OH) 6.490e-13 -1.254 0.00 ! kOH from: Atkinson (1994) OHRH 0.953 ! HO2. OHRR 0.046 ! RO2-R. OHNR 0.001 ! RO2-N. OHA1 0.046 ! HCHO OHA2 0.046 ! CCHO OHK3 0.953 ! ACET OHXC -0.003 ! C bal. calc. ! OH reaction generated Fri Mar 16 12:40:56 2001 PST ! N-C3-OH : CH3-CH2-CH2-OH ! K(OH) 5.530e-12 ! kOH for T=298 only. ! kOH from: Atkinson (1994) OHRH 0.759 ! HO2. OHRR 0.238 ! RO2-R. OHNR 0.003 ! RO2-N. OHA1 0.208 ! HCHO OHA2 0.207 ! CCHO OHA3 0.790 ! RCHO OHXC -0.009 ! C bal. calc. ! OH reaction generated Fri Mar 16 12:40:58 2001 PST ! I-C4-OH : CH3-CH(CH3)-CH2-OH ! K(OH) 6.914e-12 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRH 0.560 ! HO2. OHRR 0.403 ! RO2-R. OHNR 0.037 ! RO2-N. OHA1 0.393 ! HCHO OHA2 0.036 ! CCHO OHA3 0.607 ! RCHO OHK3 0.319 ! ACET OHXC 0.531 ! C bal. calc. ! OH reaction generated Fri Mar 16 12:41:00 2001 PST ! N-C4-OH : CH3-CH2-CH2-CH2-OH ! K(OH) 8.570e-12 ! kOH for T=298 only. ! kOH from: Atkinson (1994) OHRH 0.517 ! HO2. OHRR 0.470 ! RO2-R. OHNR 0.013 ! RO2-N. OHA1 0.308 ! HCHO OHA2 0.080 ! CCHO OHA3 0.827 ! RCHO OHK6 0.093 ! PROD2 OHXC 0.414 ! C bal. calc. ! OH reaction generated Fri Mar 16 12:41:03 2001 PST ! S-C4-OH : CH3-CH(OH)-CH2-CH3 ! K(OH) 9.950e-12 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRH 0.829 ! HO2. OHRR 0.165 ! RO2-R. OHNR 0.006 ! RO2-N. OHA1 0.016 ! HCHO OHA2 0.238 ! CCHO OHA3 0.033 ! RCHO OHK4 0.843 ! MEK OHXC 0.005 ! C bal. calc. ! OH reaction generated Fri Mar 16 12:41:06 2001 PST ! T-C4-OH : CH3-C(CH3)(OH)-CH3 ! K(OH) 3.860e-13 -0.640 0.00 ! kOH from: Atkinson (1989) OHRR 0.693 ! RO2-R. OHNR 0.052 ! RO2-N. OHR2 0.000 ! R2O2. OHTO 0.254 ! TBU-O. OHA1 0.693 ! HCHO OHK3 0.693 ! ACET OHXC 0.150 ! C bal. calc. ! OH reaction generated Fri Mar 16 12:41:07 2001 PST ! CC5-OH : *CH(OH)-CH2-CH2-CH2-CH2-* ! K(OH) 1.070e-11 ! kOH for T=298 only. ! kOH from: Wallington et al (1988a). OHRH 0.399 ! HO2. OHRR 0.562 ! RO2-R. OHNR 0.039 ! RO2-N. OHCO 0.004 ! CO OHA1 0.101 ! HCHO OHA3 0.330 ! RCHO OHK4 0.631 ! MEK OHXC 1.147 ! C bal. calc. ! OH reaction generated Fri Mar 16 12:41:11 2001 PST ! 2-C5OH : CH3-CH(OH)-CH2-CH2-CH3 ! K(OH) 1.180e-11 ! kOH for T=298 only. ! kOH from: Wallington et al (1988a). OHRH 0.643 ! HO2. OHRR 0.335 ! RO2-R. OHNR 0.022 ! RO2-N. OHA1 0.034 ! HCHO OHA2 0.146 ! CCHO OHA3 0.141 ! RCHO OHK4 0.730 ! MEK OHK6 0.093 ! PROD2 OHXC 0.642 ! C bal. calc. ! OH reaction generated Fri Mar 16 12:41:17 2001 PST ! 3-C5OH : CH3-CH2-CH(OH)-CH2-CH3 ! K(OH) 1.220e-11 ! kOH for T=298 only. ! kOH from: Wallington et al (1988a). OHRH 0.765 ! HO2. OHRR 0.220 ! RO2-R. OHNR 0.015 ! RO2-N. OHA2 0.174 ! CCHO OHA3 0.195 ! RCHO OHK4 0.790 ! MEK OHXC 0.817 ! C bal. calc. ! OH reaction generated Fri Mar 16 12:41:19 2001 PST ! C5OH : CH3-CH2-CH2-CH2-CH2-OH ! K(OH) 1.110e-11 ! kOH for T=298 only. ! kOH from: Atkinson (1994) OHRH 0.375 ! HO2. OHRR 0.590 ! RO2-R. OHNR 0.035 ! RO2-N. OHA1 0.262 ! HCHO OHA2 0.027 ! CCHO OHA3 0.881 ! RCHO OHK6 0.084 ! PROD2 OHXC 1.326 ! C bal. calc. ! OH reaction generated Fri Mar 16 12:41:23 2001 PST ! CC6-OH : *CH(OH)-CH2-CH2-CH2-CH2-CH2-* ! K(OH) 1.744e-11 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRH 0.439 ! HO2. OHRR 0.506 ! RO2-R. OHNR 0.055 ! RO2-N. OHA1 0.040 ! HCHO OHA3 0.246 ! RCHO OHK6 0.705 ! PROD2 OHXC 0.664 ! C bal. calc. ! OH reaction generated Fri Mar 16 12:41:29 2001 PST ! 1-C6OH : CH3-CH2-CH2-CH2-CH2-CH2-OH ! K(OH) 1.250e-11 ! kOH for T=298 only. ! kOH from: Atkinson (1994) OHRH 0.108 ! HO2. OHRR 0.814 ! RO2-R. OHNR 0.078 ! RO2-N. OHA1 0.098 ! HCHO OHA2 0.002 ! CCHO OHA3 0.675 ! RCHO OHK6 0.253 ! PROD2 OHXC 1.885 ! C bal. calc. ! OH reaction generated Fri Mar 16 12:41:37 2001 PST ! 2-C6OH : CH3-CH(OH)-CH2-CH2-CH2-CH3 ! K(OH) 1.210e-11 ! kOH for T=298 only. ! kOH from: Wallington et al (1988a). OHRH 0.543 ! HO2. OHRR 0.415 ! RO2-R. OHNR 0.043 ! RO2-N. OHA1 0.032 ! HCHO OHA2 0.130 ! CCHO OHA3 0.150 ! RCHO OHK6 0.808 ! PROD2 OHXC 0.155 ! C bal. calc. ! OH reaction generated Fri Mar 16 12:41:44 2001 PST ! 1-C7OH : CH3-CH2-CH2-CH2-CH2-CH2-CH2-OH ! K(OH) 1.370e-11 ! kOH for T=298 only. ! kOH from: Atkinson (1994) OHRR 0.862 ! RO2-R. OHNR 0.138 ! RO2-N. OHR2 0.025 ! R2O2. OHA1 0.054 ! HCHO OHA3 0.547 ! RCHO OHK6 0.315 ! PROD2 OHXC 2.587 ! C bal. calc. ! OH reaction generated Fri Mar 16 12:41:52 2001 PST ! 1-C8-OH : CH3-CH2-CH2-CH2-CH2-CH2-CH2-CH2-OH ! K(OH) 2.020e-11 ! kOH for T=298 only. ! kOH from: Carter et al (1999a) OHRR 0.771 ! RO2-R. OHNR 0.229 ! RO2-N. OHR2 0.320 ! R2O2. OHA1 0.054 ! HCHO OHA3 0.387 ! RCHO OHK6 0.384 ! PROD2 OHXC 3.108 ! C bal. calc. ! OH reaction generated Fri Mar 16 12:42:08 2001 PST ! 2-C8-OH : CH3-CH(OH)-CH2-CH2-CH2-CH2-CH2-CH3 ! K(OH) 2.520e-11 ! kOH for T=298 only. ! kOH from: Carter et al (1999a) OHRH 0.062 ! HO2. OHRR 0.775 ! RO2-R. OHNR 0.163 ! RO2-N. OHA1 0.008 ! HCHO OHA2 0.183 ! CCHO OHA3 0.198 ! RCHO OHK6 0.640 ! PROD2 OHXC 2.219 ! C bal. calc. ! OH reaction generated Fri Mar 16 12:42:22 2001 PST ! 2-ETC6OH : CH3-CH2-CH(CH2-OH)-CH2-CH2-CH2-CH3 ! K(OH) 1.328e-11 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRH 0.006 ! HO2. OHRR 0.841 ! RO2-R. OHNR 0.153 ! RO2-N. OHA1 0.339 ! HCHO OHA2 0.040 ! CCHO OHA3 0.604 ! RCHO OHK6 0.327 ! PROD2 OHXC 2.884 ! C bal. calc. ! OH reaction generated Fri Mar 16 12:42:45 2001 PST ! 3-C8-OH : CH3-CH2-CH(OH)-CH2-CH2-CH2-CH2-CH3 ! K(OH) 3.140e-11 ! kOH for T=298 only. ! kOH from: Carter et al (1999a) OHRH 0.225 ! HO2. OHRR 0.641 ! RO2-R. OHNR 0.134 ! RO2-N. OHA2 0.142 ! CCHO OHA3 0.355 ! RCHO OHK6 0.609 ! PROD2 OHXC 2.190 ! C bal. calc. ! OH reaction generated Fri Mar 16 12:43:00 2001 PST ! 4-C8-OH : CH3-CH2-CH2-CH(OH)-CH2-CH2-CH2-CH3 ! K(OH) 2.870e-11 ! kOH for T=298 only. ! kOH from: Carter et al (1999a) OHRH 0.161 ! HO2. OHRR 0.693 ! RO2-R. OHNR 0.145 ! RO2-N. OHA3 0.715 ! RCHO OHK6 0.497 ! PROD2 OHXC 2.002 ! C bal. calc. ! OH reaction generated Fri Mar 16 12:43:12 2001 PST ! I-C10-OH : CH3-CH(CH3)-CH2-CH2-CH2-CH2-CH2-CH2-CH2-OH ! K(OH) 1.543e-11 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.700 ! RO2-R. OHNR 0.300 ! RO2-N. OHR2 0.310 ! R2O2. OHA1 0.037 ! HCHO OHA3 0.395 ! RCHO OHK3 0.009 ! ACET OHK6 0.306 ! PROD2 OHXC 5.121 ! C bal. calc. ! OH reaction generated Fri Mar 16 12:43:35 2001 PST ! ET-GLYCL : HO-CH2-CH2-OH ! K(OH) 1.470e-11 ! kOH for T=298 only. ! kOH from: Aschmann and Atkinson (1998). OHRH 1.000 ! HO2. OHA1 0.067 ! HCHO OHA2 0.966 ! CCHO OHXC 0.000 ! C bal. calc. ! OH reaction generated Fri Mar 16 12:43:37 2001 PST ! PR-GLYCL : CH3-CH(OH)-CH2-OH ! K(OH) 2.150e-11 ! kOH for T=298 only. ! kOH from: Aschmann and Atkinson (1998). OHRH 0.987 ! HO2. OHRR 0.013 ! RO2-R. OHA1 0.039 ! HCHO OHA2 0.039 ! CCHO OHA3 0.315 ! RCHO OHK4 0.646 ! MEK OHXC -0.646 ! C bal. calc. ! OH reaction generated Fri Mar 16 12:43:38 2001 PST ! 12-C4OH2 : CH3-CH2-CH(OH)-CH2-OH ! K(OH) 1.586e-11 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRH 0.916 ! HO2. OHRR 0.081 ! RO2-R. OHNR 0.003 ! RO2-N. OHA1 0.022 ! HCHO OHA2 0.140 ! CCHO OHA3 0.285 ! RCHO OHK4 0.641 ! MEK OHXC 0.257 ! C bal. calc. ! OH reaction generated Fri Mar 16 12:43:40 2001 PST ! GLYCERL : HO-CH2-CH(OH)-CH2-OH ! K(OH) 1.872e-11 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRH 1.000 ! HO2. OHA1 0.017 ! HCHO OHA2 0.017 ! CCHO OHA3 0.435 ! RCHO OHK6 0.548 ! PROD2 OHXC -1.645 ! C bal. calc. ! OH reaction generated Fri Mar 16 12:43:41 2001 PST ! 2M24C5OH : CH3-C(CH3)(OH)-CH2-CH(OH)-CH3 ! K(OH) 1.056e-11 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRH 0.785 ! HO2. OHRR 0.195 ! RO2-R. OHNR 0.020 ! RO2-N. OHA1 0.046 ! HCHO OHA2 0.012 ! CCHO OHA3 0.141 ! RCHO OHK3 0.133 ! ACET OHK4 0.785 ! MEK OHK6 0.042 ! PROD2 OHXC 1.595 ! C bal. calc. ! OH reaction generated Fri Mar 16 12:43:47 2001 PST ! C6-GLYCL : CH3-CH2-CH2-CH2-CH(OH)-CH2-OH ! K(OH) 1.870e-11 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRH 0.779 ! HO2. OHRR 0.200 ! RO2-R. OHNR 0.022 ! RO2-N. OHA2 0.069 ! CCHO OHA3 0.360 ! RCHO OHK6 0.618 ! PROD2 OHXC 0.943 ! C bal. calc. ! OH reaction generated Fri Mar 16 12:43:51 2001 PST ! ME-O-ME : CH3-O-CH3 ! K(OH) 1.040e-11 0.739 0.00 ! kOH from: Atkinson (1994) OHRR 1.000 ! RO2-R. OHA1 0.079 ! HCHO OHXX 0.961 ! INERT OHXC 0.961 ! C bal. calc. ! OH reaction generated Fri Mar 16 12:43:52 2001 PST ! TME-OX : *CH2-CH2-CH2-O-* ! K(OH) 1.030e-11 ! kOH for T=298 only. ! kOH from: Daguat et al (1988a). OHRR 0.138 ! RO2-R. OHR2 1.862 ! R2O2. OHQ2 0.862 ! RCO-O2. OHCO 0.003 ! CO OHA1 0.006 ! HCHO OHA3 0.135 ! RCHO OHGL 0.000 ! GLY OHXC -0.000 ! C bal. calc. ! OH reaction generated Fri Mar 16 12:43:53 2001 PST ! THF : *CH2-CH2-CH2-CH2-O-* ! K(OH) 1.610e-11 ! kOH for T=298 only. ! kOH from: Atkinson (1994) OHRR 0.911 ! RO2-R. OHNR 0.079 ! RO2-N. OHR2 1.032 ! R2O2. OHQ2 0.009 ! RCO-O2. OHCO 0.049 ! CO OHA1 0.013 ! HCHO OHA3 0.861 ! RCHO OHK6 0.050 ! PROD2 OHXC 0.549 ! C bal. calc. ! OH reaction generated Fri Mar 16 12:43:56 2001 PST ! ET-O-ET : CH3-CH2-O-CH2-CH3 ! K(OH) 8.020e-13 -1.663 0.00 ! kOH from: Atkinson (1994) OHRR 0.131 ! RO2-R. OHNR 0.040 ! RO2-N. OHR2 0.848 ! R2O2. OHME 0.829 ! C-O2. OHA1 0.006 ! HCHO OHA2 0.168 ! CCHO OHA3 0.006 ! RCHO OHK4 0.858 ! MEK OHK6 0.010 ! PROD2 OHXC -0.924 ! C bal. calc. ! OH reaction generated Fri Mar 16 12:43:58 2001 PST ! METHYLAL : CH3-O-CH2-O-CH3 ! K(OH) 4.900e-12 ! kOH for T=298 only. ! kOH from: Sidebottom et al (1997). OHRH 0.000 ! HO2. OHRR 1.000 ! RO2-R. OHA1 0.086 ! HCHO OHK6 0.639 ! PROD2 OHXX 0.359 ! INERT OHXC -1.282 ! C bal. calc. ! OH reaction generated Fri Mar 16 12:44:00 2001 PST ! AM-THF : *CH(CH3)-CH2-CH2-CH2-O-* ! K(OH) 2.520e-12 -1.292 0.00 ! kOH from: Wallington et al (1990). OHRR 0.817 ! RO2-R. OHNR 0.141 ! RO2-N. OHR2 1.221 ! R2O2. OHME 0.040 ! C-O2. OHQ2 0.003 ! RCO-O2. OHCO 0.010 ! CO OHA1 0.025 ! HCHO OHA2 0.008 ! CCHO OHA3 0.847 ! RCHO OHK4 0.000 ! MEK OHK6 0.007 ! PROD2 OHGL 0.000 ! GLY OHZ1 0.000 ! HCOOH OHXC 1.472 ! C bal. calc. ! OH reaction generated Fri Mar 16 12:44:08 2001 PST ! THP : *CH2-CH2-CH2-CH2-CH2-O-* ! K(OH) 1.380e-11 ! kOH for T=298 only. ! kOH from: Daguat et al (1988a). OHRR 0.832 ! RO2-R. OHNR 0.167 ! RO2-N. OHR2 1.597 ! R2O2. OHQ2 0.001 ! RCO-O2. OHCO 0.025 ! CO OHA1 0.026 ! HCHO OHA3 0.702 ! RCHO OHK4 0.000 ! MEK OHK6 0.130 ! PROD2 OHGL 0.001 ! GLY OHZ1 0.000 ! HCOOH OHXC 1.055 ! C bal. calc. ! OH reaction generated Fri Mar 16 12:44:14 2001 PST ! ET-O-IPR : CH3-CH(CH3)-O-CH2-CH3 ! K(OH) 2.439e-11 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.246 ! RO2-R. OHNR 0.066 ! RO2-N. OHR2 0.701 ! R2O2. OHME 0.688 ! C-O2. OHA1 0.008 ! HCHO OHA2 0.221 ! CCHO OHA3 0.002 ! RCHO OHK3 0.219 ! ACET OHK4 0.709 ! MEK OHK6 0.004 ! PROD2 OHXC -0.052 ! C bal. calc. ! OH reaction generated Fri Mar 16 12:44:17 2001 PST ! MNBE : CH3-CH2-CH2-CH2-O-CH3 ! K(OH) 1.480e-11 ! kOH for T=298 only. ! kOH from: Atkinson (1994) OHRR 0.919 ! RO2-R. OHNR 0.081 ! RO2-N. OHR2 0.783 ! R2O2. OHA1 0.006 ! HCHO OHA2 0.038 ! CCHO OHA3 0.720 ! RCHO OHK4 0.068 ! MEK OHK6 0.131 ! PROD2 OHXX 0.693 ! INERT OHXC 0.521 ! C bal. calc. ! OH reaction generated Fri Mar 16 12:44:24 2001 PST ! MTBE : CH3-C(CH3)(CH3)-O-CH3 ! K(OH) 5.890e-13 -0.960 2.00 ! kOH from: Atkinson (1994) OHRR 0.743 ! RO2-R. OHNR 0.078 ! RO2-N. OHR2 0.381 ! R2O2. OHME 0.162 ! C-O2. OHTO 0.016 ! TBU-O. OHA1 0.234 ! HCHO OHK3 0.024 ! ACET OHK4 0.719 ! MEK OHK6 0.007 ! PROD2 OHZ1 0.000 ! HCOOH OHXX 0.155 ! INERT OHXC 0.939 ! C bal. calc. ! OH reaction generated Fri Mar 16 12:44:27 2001 PST ! ENBE : CH3-CH2-CH2-CH2-O-CH2-CH3 ! K(OH) 2.130e-11 ! kOH for T=298 only. ! kOH from: Atkinson (1994) OHRR 0.589 ! RO2-R. OHNR 0.116 ! RO2-N. OHR2 0.882 ! R2O2. OHME 0.295 ! C-O2. OHA1 0.011 ! HCHO OHA2 0.086 ! CCHO OHA3 0.491 ! RCHO OHK4 0.721 ! MEK OHK6 0.104 ! PROD2 OHXC -0.154 ! C bal. calc. ! OH reaction generated Fri Mar 16 12:44:34 2001 PST ! ETBE : CH3-C(CH3)(CH3)-O-CH2-CH3 ! K(OH) 8.840e-12 ! kOH for T=298 only. ! kOH from: Atkinson (1994) OHRR 0.143 ! RO2-R. OHNR 0.101 ! RO2-N. OHR2 0.810 ! R2O2. OHME 0.644 ! C-O2. OHTO 0.112 ! TBU-O. OHA1 0.055 ! HCHO OHA2 0.127 ! CCHO OHA3 0.018 ! RCHO OHK3 0.016 ! ACET OHK4 0.644 ! MEK OHXX 0.109 ! INERT OHXC 1.317 ! C bal. calc. ! OH reaction generated Fri Mar 16 12:44:37 2001 PST ! MTAE : CH3-CH2-C(CH3)(CH3)-O-CH3 ! K(OH) 7.910e-12 ! kOH for T=298 only. ! kOH from: Wallington et al (1988a). OHRR 0.535 ! RO2-R. OHNR 0.130 ! RO2-N. OHR2 1.076 ! R2O2. OHME 0.335 ! C-O2. OHA1 0.219 ! HCHO OHA2 0.512 ! CCHO OHA3 0.028 ! RCHO OHK3 0.055 ! ACET OHK4 0.330 ! MEK OHK6 0.026 ! PROD2 OHZ1 0.001 ! HCOOH OHXX 0.432 ! INERT OHXC 1.488 ! C bal. calc. ! OH reaction generated Fri Mar 16 12:44:43 2001 PST ! PR-O-PR : CH3-CH2-CH2-O-CH2-CH2-CH3 ! K(OH) 1.180e-12 -1.639 0.00 ! kOH from: Atkinson (1994) OHRR 0.894 ! RO2-R. OHNR 0.106 ! RO2-N. OHR2 0.961 ! R2O2. OHA1 0.000 ! HCHO OHA2 0.873 ! CCHO OHA3 0.014 ! RCHO OHK4 0.795 ! MEK OHK6 0.085 ! PROD2 OHXC -0.116 ! C bal. calc. ! OH reaction generated Fri Mar 16 12:44:47 2001 PST ! 2BU-THF : *CH(CH2-CH2-CH2-CH3)-CH2-CH2-CH2-O-* ! K(OH) 2.764e-11 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.642 ! RO2-R. OHNR 0.356 ! RO2-N. OHR2 1.176 ! R2O2. OHQ2 0.002 ! RCO-O2. OHCO 0.001 ! CO OHC2 0.000 ! CO2 OHA1 0.034 ! HCHO OHA3 0.733 ! RCHO OHK4 0.001 ! MEK OHK6 0.003 ! PROD2 OHGL 0.000 ! GLY OHMG 0.000 ! MGLY OHZ1 0.002 ! HCOOH OHXC 3.603 ! C bal. calc. ! OH reaction generated Fri Mar 16 12:45:10 2001 PST ! BU-O-BU : CH3-CH2-CH2-CH2-O-CH2-CH2-CH2-CH3 ! K(OH) 2.880e-11 ! kOH for T=298 only. ! kOH from: Atkinson (1994) OHRR 0.788 ! RO2-R. OHNR 0.212 ! RO2-N. OHR2 0.903 ! R2O2. OHA1 0.000 ! HCHO OHA2 0.032 ! CCHO OHA3 0.737 ! RCHO OHK4 0.651 ! MEK OHK6 0.147 ! PROD2 OHXC 0.969 ! C bal. calc. ! OH reaction generated Fri Mar 16 12:45:19 2001 PST ! IBU2-O : CH3-CH(CH3)-CH2-O-CH2-CH(CH3)-CH3 ! K(OH) 2.600e-11 ! kOH for T=298 only. ! kOH from: Bennett and Kerr (1989). OHRR 0.767 ! RO2-R. OHNR 0.233 ! RO2-N. OHR2 0.961 ! R2O2. OHA1 0.019 ! HCHO OHA2 0.000 ! CCHO OHA3 0.006 ! RCHO OHK3 0.763 ! ACET OHK4 0.778 ! MEK OHK6 0.013 ! PROD2 OHZ1 0.000 ! HCOOH OHXC 1.083 ! C bal. calc. ! OH reaction generated Fri Mar 16 12:45:32 2001 PST ! C5-O-C5 : CH3-CH2-CH2-CH2-CH2-O-CH2-CH2-CH2-CH2-CH3 ! K(OH) 3.470e-11 ! kOH for T=298 only. ! kOH from: Wallington et al (1988b). OHRR 0.679 ! RO2-R. OHNR 0.321 ! RO2-N. OHR2 1.291 ! R2O2. OHA1 0.000 ! HCHO OHA2 0.007 ! CCHO OHA3 0.604 ! RCHO OHK6 0.704 ! PROD2 OHXC 2.027 ! C bal. calc. ! OH reaction generated Fri Mar 16 12:45:51 2001 PST ! MEO-ETOH : CH3-O-CH2-CH2-OH ! K(OH) 4.500e-12 -0.646 0.00 ! kOH from: Daguat et al (1988a). OHRH 0.278 ! HO2. OHRR 0.722 ! RO2-R. OHA1 0.648 ! HCHO OHA2 0.000 ! CCHO OHA3 0.307 ! RCHO OHK6 0.048 ! PROD2 OHXX 0.642 ! INERT OHXC 0.497 ! C bal. calc. ! OH reaction generated Fri Mar 16 12:45:53 2001 PST ! 2MEOC3OH : CH3-O-CH(CH3)-CH2-OH ! K(OH) 2.526e-11 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRH 0.161 ! HO2. OHRR 0.806 ! RO2-R. OHNR 0.033 ! RO2-N. OHA1 0.763 ! HCHO OHA2 0.001 ! CCHO OHA3 0.178 ! RCHO OHK6 0.027 ! PROD2 OHXX 0.761 ! INERT OHXC 1.580 ! C bal. calc. ! OH reaction generated Fri Mar 16 12:45:55 2001 PST ! ETO-ETOH : CH3-CH2-O-CH2-CH2-OH ! K(OH) 1.870e-11 ! kOH for T=298 only. ! kOH from: Dagaut et al (1988a) [Value of Hartmann et al (1986) not consisten ! t with chamber data (Carter et al, 1993a)] OHRH 0.015 ! HO2. OHRR 0.792 ! RO2-R. OHNR 0.020 ! RO2-N. OHME 0.173 ! C-O2. OHA1 0.549 ! HCHO OHA2 0.083 ! CCHO OHA3 0.268 ! RCHO OHK4 0.437 ! MEK OHK6 0.206 ! PROD2 OHXC -0.793 ! C bal. calc. ! OH reaction generated Fri Mar 16 12:45:57 2001 PST ! MEOC3OH : CH3-CH(OH)-CH2-O-CH3 ! K(OH) 2.000e-11 ! kOH for T=298 only. ! kOH from: Average of values of Porter et al (1995) and Aschmann and Atkinson ! (1998) OHRH 0.390 ! HO2. OHRR 0.600 ! RO2-R. OHNR 0.010 ! RO2-N. OHA1 0.001 ! HCHO OHA2 0.571 ! CCHO OHK6 0.419 ! PROD2 OHXX 0.571 ! INERT OHXC -0.287 ! C bal. calc. ! OH reaction generated Fri Mar 16 12:46:00 2001 PST ! 2PROETOH : CH3-CH2-CH2-O-CH2-CH2-OH ! K(OH) 2.466e-11 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.943 ! RO2-R. OHNR 0.057 ! RO2-N. OHR2 0.245 ! R2O2. OHA1 0.406 ! HCHO OHA2 0.369 ! CCHO OHA3 0.165 ! RCHO OHK4 0.368 ! MEK OHK6 0.410 ! PROD2 OHXC -0.912 ! C bal. calc. ! OH reaction generated Fri Mar 16 12:46:03 2001 PST ! 3ETOC3OH : CH3-CH2-O-CH2-CH2-CH2-OH ! K(OH) 2.200e-11 ! kOH for T=298 only. ! kOH from: Daguat et al (1988a). OHRR 0.706 ! RO2-R. OHNR 0.055 ! RO2-N. OHR2 0.475 ! R2O2. OHME 0.239 ! C-O2. OHA1 0.690 ! HCHO OHA2 0.127 ! CCHO OHA3 0.280 ! RCHO OHK4 0.393 ! MEK OHK6 0.271 ! PROD2 OHXC -0.551 ! C bal. calc. ! OH reaction generated Fri Mar 16 12:46:07 2001 PST ! 3MEOC4OH : CH3-O-CH(CH3)-CH2-CH2-OH ! K(OH) 2.360e-12 ! kOH for T=298 only. ! kOH from: Daguat et al (1988a). OHRR 0.933 ! RO2-R. OHNR 0.055 ! RO2-N. OHR2 0.582 ! R2O2. OHME 0.012 ! C-O2. OHA1 1.171 ! HCHO OHA2 0.155 ! CCHO OHA3 0.190 ! RCHO OHK4 0.001 ! MEK OHK6 0.037 ! PROD2 OHZ1 0.000 ! HCOOH OHXX 0.714 ! INERT OHXC 1.664 ! C bal. calc. ! OH reaction generated Fri Mar 16 12:46:11 2001 PST ! ETOC3OH : CH3-CH(OH)-CH2-O-CH2-CH3 ! K(OH) 2.616e-11 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRH 0.163 ! HO2. OHRR 0.633 ! RO2-R. OHNR 0.044 ! RO2-N. OHME 0.160 ! C-O2. OHA1 0.033 ! HCHO OHA2 0.415 ! CCHO OHK4 0.349 ! MEK OHK6 0.574 ! PROD2 OHXC -1.127 ! C bal. calc. ! OH reaction generated Fri Mar 16 12:46:13 2001 PST ! DET-GLCL : HO-CH2-CH2-O-CH2-CH2-OH ! K(OH) 2.753e-11 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRH 0.293 ! HO2. OHRR 0.679 ! RO2-R. OHNR 0.028 ! RO2-N. OHA1 0.679 ! HCHO OHA3 0.293 ! RCHO OHK6 0.679 ! PROD2 OHXC -1.802 ! C bal. calc. ! OH reaction generated Fri Mar 16 12:46:15 2001 PST ! 3MOMC4OH : CH3-O-C(CH3)(CH3)-CH2-CH2-OH ! K(OH) 7.101e-12 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRH 0.127 ! HO2. OHRR 0.655 ! RO2-R. OHNR 0.054 ! RO2-N. OHME 0.164 ! C-O2. OHA1 0.110 ! HCHO OHA2 0.202 ! CCHO OHA3 0.599 ! RCHO OHK3 0.026 ! ACET OHK6 0.141 ! PROD2 OHZ1 0.001 ! HCOOH OHXX 0.180 ! INERT OHXC 2.100 ! C bal. calc. ! OH reaction generated Fri Mar 16 12:46:22 2001 PST ! BUO-ETOH : CH3-CH2-CH2-CH2-O-CH2-CH2-OH ! K(OH) 2.570e-11 ! kOH for T=298 only. ! kOH from: Average of values of Dagaut et al (1988a), Stemmler et al (1996) a ! nd Aschmann and Atkinson (1998). OHRR 0.888 ! RO2-R. OHNR 0.112 ! RO2-N. OHR2 0.133 ! R2O2. OHA1 0.550 ! HCHO OHA2 0.013 ! CCHO OHA3 0.318 ! RCHO OHK4 0.508 ! MEK OHK6 0.260 ! PROD2 OHXC 0.211 ! C bal. calc. ! OH reaction generated Fri Mar 16 12:46:29 2001 PST ! PROXC3OH : CH3-CH(OH)-CH2-O-CH2-CH2-CH3 ! K(OH) 2.910e-11 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.927 ! RO2-R. OHNR 0.073 ! RO2-N. OHR2 0.047 ! R2O2. OHA1 0.000 ! HCHO OHA2 0.635 ! CCHO OHK4 0.302 ! MEK OHK6 0.625 ! PROD2 OHXC -0.666 ! C bal. calc. ! OH reaction generated Fri Mar 16 12:46:34 2001 PST ! MOEOETOH : CH3-O-CH2-CH2-O-CH2-CH2-OH ! K(OH) 3.406e-11 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.941 ! RO2-R. OHNR 0.059 ! RO2-N. OHR2 0.452 ! R2O2. OHA1 0.307 ! HCHO OHA2 0.001 ! CCHO OHA3 0.216 ! RCHO OHK4 0.019 ! MEK OHK6 0.717 ! PROD2 OHZ1 0.001 ! HCOOH OHXX 0.518 ! INERT OHXC -1.211 ! C bal. calc. ! OH reaction generated Fri Mar 16 12:46:39 2001 PST ! BUOC3OH : CH3-CH(OH)-CH2-O-CH2-CH2-CH2-CH3 ! K(OH) 3.760e-11 ! kOH for T=298 only. ! kOH from: Atkinson et al (2000c). Report to ACC Glycol Ethers Panel, In prep ! aration (November). OHRR 0.885 ! RO2-R. OHNR 0.115 ! RO2-N. OHR2 0.035 ! R2O2. OHA1 0.000 ! HCHO OHA2 0.457 ! CCHO OHA3 0.202 ! RCHO OHK4 0.411 ! MEK OHK6 0.477 ! PROD2 OHXC 0.284 ! C bal. calc. ! OH reaction generated Fri Mar 16 12:46:46 2001 PST ! PG-1TB-E : CH3-C(CH3)(CH3)-O-CH2-CH(OH)-CH3 ! K(OH) 1.871e-11 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRH 0.407 ! HO2. OHRR 0.497 ! RO2-R. OHNR 0.077 ! RO2-N. OHME 0.019 ! C-O2. OHA1 0.025 ! HCHO OHA2 0.452 ! CCHO OHK3 0.001 ! ACET OHK4 0.451 ! MEK OHK6 0.471 ! PROD2 OHXC 0.956 ! C bal. calc. ! OH reaction generated Fri Mar 16 12:46:49 2001 PST ! PG-2TB-E : CH3-C(CH3)(CH3)-O-CH(CH3)-CH2-OH ! K(OH) 2.462e-11 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRH 0.132 ! HO2. OHRR 0.738 ! RO2-R. OHNR 0.115 ! RO2-N. OHME 0.015 ! C-O2. OHA1 0.722 ! HCHO OHA2 0.000 ! CCHO OHA3 0.166 ! RCHO OHK3 0.000 ! ACET OHK6 0.015 ! PROD2 OHXX 0.704 ! INERT OHXC 4.279 ! C bal. calc. ! OH reaction generated Fri Mar 16 12:46:52 2001 PST ! DPR-GLCL : CH3-CH(OH)-CH2-O-CH2-CH(OH)-CH3 ! K(OH) 3.640e-11 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRH 0.464 ! HO2. OHRR 0.484 ! RO2-R. OHNR 0.052 ! RO2-N. OHA2 0.484 ! CCHO OHK6 0.948 ! PROD2 OHXC -0.968 ! C bal. calc. ! OH reaction generated Fri Mar 16 12:47:00 2001 PST ! DPRGOME : CH3-CH(OH)-CH2-O-CH(CH3)-CH2-O-CH3 ! K(OH) 4.885e-11 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.785 ! RO2-R. OHNR 0.125 ! RO2-N. OHR2 0.475 ! R2O2. OHME 0.090 ! C-O2. OHA1 0.047 ! HCHO OHA2 0.209 ! CCHO OHK4 0.014 ! MEK OHK6 0.856 ! PROD2 OHZ1 0.001 ! HCOOH OHXX 0.511 ! INERT OHXC -0.010 ! C bal. calc. ! OH reaction generated Fri Mar 16 12:47:06 2001 PST ! TPRGOME : CH3-CH(OH)-CH2-O-CH(CH3)-CH2-O-CH(CH3)-CH2-O-CH3 ! K(OH) 7.834e-11 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.572 ! RO2-R. OHNR 0.260 ! RO2-N. OHR2 0.993 ! R2O2. OHME 0.169 ! C-O2. OHA1 0.029 ! HCHO OHA2 0.144 ! CCHO OHA3 0.000 ! RCHO OHK4 0.098 ! MEK OHK6 0.946 ! PROD2 OHZ1 0.021 ! HCOOH OHZ2 0.000 ! CCO-OH OHXX 0.402 ! INERT OHXC 1.467 ! C bal. calc. ! OH reaction generated Fri Mar 16 12:47:33 2001 PST ! ME-FORM : CH3-O-CHO ! K(OH) 2.270e-13 ! kOH for T=298 only. ! kOH from: Wallington et al (1988d). OHRR 1.000 ! RO2-R. OHCO 0.657 ! CO OHC2 0.041 ! CO2 OHA1 0.041 ! HCHO OHZ1 0.657 ! HCOOH OHXX 0.302 ! INERT OHXC 0.302 ! C bal. calc. ! OH reaction generated Fri Mar 16 12:47:34 2001 PST ! ET-FORM : CH3-CH2-O-CHO ! K(OH) 1.020e-12 ! kOH for T=298 only. ! kOH from: Wallington et al (1988d). OHRR 0.128 ! RO2-R. OHR2 0.872 ! R2O2. OHQ1 0.718 ! CCO-O2. OHQ2 0.154 ! RCO-O2. OHC2 0.083 ! CO2 OHA2 0.083 ! CCHO OHA3 0.014 ! RCHO OHZ1 0.718 ! HCOOH OHXX 0.032 ! INERT OHXC 0.064 ! C bal. calc. ! OH reaction generated Fri Mar 16 12:47:35 2001 PST ! ME-ACET : CH3-O-CO-CH3 ! K(OH) 8.300e-13 0.517 0.00 ! kOH from: Wallington et al (1988d). OHRR 0.985 ! RO2-R. OHNR 0.015 ! RO2-N. OHCO 0.640 ! CO OHZ2 0.640 ! CCO-OH OHXX 0.345 ! INERT OHXC 0.646 ! C bal. calc. ! OH reaction generated Fri Mar 16 12:47:37 2001 PST ! C3-FORM : CH3-CH2-CH2-O-CHO ! K(OH) 2.380e-12 ! kOH for T=298 only. ! kOH from: Wallington et al (1988d). OHRR 0.172 ! RO2-R. OHNR 0.039 ! RO2-N. OHR2 0.789 ! R2O2. OHQ2 0.789 ! RCO-O2. OHC2 0.052 ! CO2 OHA1 0.001 ! HCHO OHA3 0.121 ! RCHO OHK4 0.033 ! MEK OHZ1 0.352 ! HCOOH OHXX 0.018 ! INERT OHXC 0.480 ! C bal. calc. ! OH reaction generated Fri Mar 16 12:47:39 2001 PST ! ET-ACET : CH3-CH2-O-CO-CH3 ! K(OH) 1.600e-12 ! kOH for T=298 only. ! kOH from: Atkinson (1989) OHRR 0.156 ! RO2-R. OHNR 0.040 ! RO2-N. OHR2 0.810 ! R2O2. OHQ1 0.804 ! CCO-O2. OHA3 0.096 ! RCHO OHK4 0.000 ! MEK OHMG 0.018 ! MGLY OHZ2 0.799 ! CCO-OH OHZ3 0.005 ! RCO-OH OHXX 0.042 ! INERT OHXC 0.153 ! C bal. calc. ! OH reaction generated Fri Mar 16 12:47:42 2001 PST ! ME-PRAT : CH3-CH2-CO-O-CH3 ! K(OH) 1.030e-12 ! kOH for T=298 only. ! kOH from: Wallington et al (1988d). OHRR 0.925 ! RO2-R. OHNR 0.043 ! RO2-N. OHR2 0.120 ! R2O2. OHQ2 0.032 ! RCO-O2. OHCO 0.239 ! CO OHA2 0.032 ! CCHO OHA3 0.239 ! RCHO OHK4 0.027 ! MEK OHK6 0.039 ! PROD2 OHBA 0.317 ! BACL OHZ3 0.200 ! RCO-OH OHXX 0.103 ! INERT OHXC 0.312 ! C bal. calc. ! OH reaction generated Fri Mar 16 12:47:44 2001 PST ! C4-FORM : CH3-CH2-CH2-CH2-O-CHO ! K(OH) 3.120e-12 ! kOH for T=298 only. ! kOH from: Wallington et al (1988d). OHRR 0.352 ! RO2-R. OHNR 0.074 ! RO2-N. OHR2 0.826 ! R2O2. OHQ2 0.574 ! RCO-O2. OHC2 0.017 ! CO2 OHA2 0.119 ! CCHO OHA3 0.066 ! RCHO OHK4 0.201 ! MEK OHK6 0.085 ! PROD2 OHZ1 0.141 ! HCOOH OHXC 0.926 ! C bal. calc. ! OH reaction generated Fri Mar 16 12:47:48 2001 PST ! ET-PRAT : CH3-CH2-O-CO-CH2-CH3 ! K(OH) 2.140e-12 ! kOH for T=298 only. ! kOH from: Wallington et al (1988d). OHRR 0.209 ! RO2-R. OHNR 0.072 ! RO2-N. OHR2 0.830 ! R2O2. OHQ1 0.718 ! CCO-O2. OHQ2 0.002 ! RCO-O2. OHA2 0.002 ! CCHO OHA3 0.149 ! RCHO OHK4 0.036 ! MEK OHK6 0.092 ! PROD2 OHBA 0.023 ! BACL OHZ3 0.626 ! RCO-OH OHXC 0.011 ! C bal. calc. ! OH reaction generated Fri Mar 16 12:47:51 2001 PST ! IPR-ACET : CH3-CH(CH3)-O-CO-CH3 ! K(OH) 3.400e-12 ! kOH for T=298 only. ! kOH from: Atkinson (1989) OHRR 0.015 ! RO2-R. OHNR 0.055 ! RO2-N. OHR2 1.034 ! R2O2. OHME 0.845 ! C-O2. OHQ1 0.085 ! CCO-O2. OHC2 0.203 ! CO2 OHA1 0.093 ! HCHO OHK3 0.203 ! ACET OHK4 0.000 ! MEK OHMG 0.011 ! MGLY OHZ2 0.085 ! CCO-OH OHXX 0.647 ! INERT OHXC 1.902 ! C bal. calc. ! OH reaction generated Fri Mar 16 12:47:55 2001 PST ! ME-BUAT : CH3-CH2-CH2-CO-O-CH3 ! K(OH) 3.040e-12 ! kOH for T=298 only. ! kOH from: Wallington et al (1988d). OHRR 0.918 ! RO2-R. OHNR 0.067 ! RO2-N. OHR2 0.168 ! R2O2. OHQ2 0.015 ! RCO-O2. OHCO 0.095 ! CO OHA1 0.001 ! HCHO OHA2 0.096 ! CCHO OHA3 0.099 ! RCHO OHK4 0.522 ! MEK OHK6 0.014 ! PROD2 OHBA 0.138 ! BACL OHMG 0.078 ! MGLY OHZ3 0.081 ! RCO-OH OHXC 0.762 ! C bal. calc. ! OH reaction generated Fri Mar 16 12:47:59 2001 PST ! ME-IBUAT : CH3-CH(CH3)-CO-O-CH3 ! K(OH) 1.730e-12 ! kOH for T=298 only. ! kOH from: Wells et al. (1999). OHRR 0.378 ! RO2-R. OHNR 0.075 ! RO2-N. OHR2 0.767 ! R2O2. OHQ2 0.546 ! RCO-O2. OHCO 0.141 ! CO OHA1 0.106 ! HCHO OHA2 0.008 ! CCHO OHA3 0.081 ! RCHO OHK3 0.539 ! ACET OHK4 0.078 ! MEK OHK6 0.010 ! PROD2 OHBA 0.078 ! BACL OHZ3 0.131 ! RCO-OH OHXC -0.289 ! C bal. calc. ! OH reaction generated Fri Mar 16 12:48:04 2001 PST ! PR-ACET : CH3-CH2-CH2-O-CO-CH3 ! K(OH) 3.400e-12 ! kOH for T=298 only. ! kOH from: Atkinson (1989) OHRR 0.440 ! RO2-R. OHNR 0.066 ! RO2-N. OHR2 0.547 ! R2O2. OHQ2 0.494 ! RCO-O2. OHCO 0.012 ! CO OHA1 0.001 ! HCHO OHA2 0.041 ! CCHO OHA3 0.050 ! RCHO OHK4 0.348 ! MEK OHMG 0.002 ! MGLY OHZ2 0.497 ! CCO-OH OHZ3 0.009 ! RCO-OH OHXX 0.029 ! INERT OHXC 0.431 ! C bal. calc. ! OH reaction generated Fri Mar 16 12:48:08 2001 PST ! BU-ACET : CH3-CH2-CH2-CH2-O-CO-CH3 ! K(OH) 4.200e-12 ! kOH for T=298 only. ! kOH from: Atkinson (1989) OHRR 0.688 ! RO2-R. OHNR 0.122 ! RO2-N. OHR2 0.515 ! R2O2. OHQ2 0.190 ! RCO-O2. OHCO 0.010 ! CO OHA2 0.116 ! CCHO OHA3 0.173 ! RCHO OHK4 0.253 ! MEK OHK6 0.262 ! PROD2 OHZ2 0.200 ! CCO-OH OHXX 0.021 ! INERT OHXC 0.932 ! C bal. calc. ! OH reaction generated Fri Mar 16 12:48:14 2001 PST ! ET-BUAT : CH3-CH2-CH2-CO-O-CH2-CH3 ! K(OH) 4.940e-12 ! kOH for T=298 only. ! kOH from: Wallington et al (1988d). OHRR 0.431 ! RO2-R. OHNR 0.108 ! RO2-N. OHR2 0.609 ! R2O2. OHQ1 0.460 ! CCO-O2. OHQ2 0.002 ! RCO-O2. OHA1 0.001 ! HCHO OHA2 0.053 ! CCHO OHA3 0.093 ! RCHO OHK4 0.281 ! MEK OHK6 0.064 ! PROD2 OHBA 0.020 ! BACL OHMG 0.038 ! MGLY OHZ3 0.395 ! RCO-OH OHXC 1.152 ! C bal. calc. ! OH reaction generated Fri Mar 16 12:48:19 2001 PST ! IBU-ACET : CH3-CH(CH3)-CH2-O-CO-CH3 ! K(OH) 4.614e-12 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.820 ! RO2-R. OHNR 0.120 ! RO2-N. OHR2 0.890 ! R2O2. OHME 0.008 ! C-O2. OHQ2 0.051 ! RCO-O2. OHCO 0.298 ! CO OHA1 0.052 ! HCHO OHA2 0.003 ! CCHO OHA3 0.015 ! RCHO OHK3 0.763 ! ACET OHK4 0.054 ! MEK OHZ2 0.349 ! CCO-OH OHXX 0.474 ! INERT OHXC 1.036 ! C bal. calc. ! OH reaction generated Fri Mar 16 12:48:23 2001 PST ! ME-PVAT : CH3-C(CH3)(CH3)-CO-O-CH3 ! K(OH) 1.180e-12 ! kOH for T=298 only. ! kOH from: Absolute rate constant determined by Orkin (unpublished results, 2 ! 000) is used. A non-Arrhenius temperatue dependence is observed, and the rat ! e constant used is the value measured for T=298K. This value is in good agre ! ement with a more imprecise relative determination of Carter et al (2000d) OHRR 0.328 ! RO2-R. OHNR 0.175 ! RO2-N. OHR2 1.198 ! R2O2. OHQ2 0.497 ! RCO-O2. OHCO 0.194 ! CO OHA1 0.619 ! HCHO OHA3 0.034 ! RCHO OHK3 0.497 ! ACET OHK4 0.100 ! MEK OHZ3 0.194 ! RCO-OH OHXC 0.070 ! C bal. calc. ! OH reaction generated Fri Mar 16 12:48:27 2001 PST ! PR-PRAT : CH3-CH2-CH2-O-CO-CH2-CH3 ! K(OH) 4.020e-12 ! kOH for T=298 only. ! kOH from: Wallington et al (1988d). OHRR 0.430 ! RO2-R. OHNR 0.105 ! RO2-N. OHR2 0.568 ! R2O2. OHQ2 0.466 ! RCO-O2. OHCO 0.010 ! CO OHA1 0.001 ! HCHO OHA2 0.037 ! CCHO OHA3 0.085 ! RCHO OHK4 0.301 ! MEK OHK6 0.050 ! PROD2 OHBA 0.011 ! BACL OHZ3 0.425 ! RCO-OH OHXX 0.023 ! INERT OHXC 0.793 ! C bal. calc. ! OH reaction generated Fri Mar 16 12:48:32 2001 PST ! SBU-ACET : CH3-CH2-CH(CH3)-O-CO-CH3 ! K(OH) 5.500e-12 ! kOH for T=298 only. ! kOH from: Atkinson (1989) OHRR 0.716 ! RO2-R. OHNR 0.110 ! RO2-N. OHR2 1.058 ! R2O2. OHQ1 0.170 ! CCO-O2. OHQ2 0.005 ! RCO-O2. OHA1 0.006 ! HCHO OHA2 0.834 ! CCHO OHA3 0.048 ! RCHO OHK4 0.011 ! MEK OHZ2 0.175 ! CCO-OH OHXX 0.657 ! INERT OHXC 2.120 ! C bal. calc. ! OH reaction generated Fri Mar 16 12:48:37 2001 PST ! TBU-ACET : CH3-C(CH3)(CH3)-O-CO-CH3 ! K(OH) 4.250e-13 ! kOH for T=298 only. ! kOH from: Smith et al (1992). OHRR 0.069 ! RO2-R. OHNR 0.161 ! RO2-N. OHR2 1.582 ! R2O2. OHME 0.771 ! C-O2. OHC2 0.185 ! CO2 OHA1 0.811 ! HCHO OHK3 0.185 ! ACET OHMG 0.069 ! MGLY OHXX 0.586 ! INERT OHXC 1.923 ! C bal. calc. ! OH reaction generated Fri Mar 16 12:48:40 2001 PST ! BU-PRAT : CH3-CH2-CH2-CH2-O-CO-CH2-CH3 ! K(OH) 5.056e-12 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.640 ! RO2-R. OHNR 0.170 ! RO2-N. OHR2 0.531 ! R2O2. OHQ2 0.190 ! RCO-O2. OHCO 0.008 ! CO OHA2 0.102 ! CCHO OHA3 0.179 ! RCHO OHK4 0.224 ! MEK OHK6 0.254 ! PROD2 OHBA 0.007 ! BACL OHZ3 0.178 ! RCO-OH OHXX 0.018 ! INERT OHXC 1.668 ! C bal. calc. ! OH reaction generated Fri Mar 16 12:48:48 2001 PST ! AM-ACET : CH3-CH2-CH2-CH2-CH2-O-CO-CH3 ! K(OH) 6.055e-12 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.764 ! RO2-R. OHNR 0.222 ! RO2-N. OHR2 0.741 ! R2O2. OHQ2 0.013 ! RCO-O2. OHA2 0.019 ! CCHO OHA3 0.214 ! RCHO OHK6 0.639 ! PROD2 OHZ2 0.013 ! CCO-OH OHXC 1.085 ! C bal. calc. ! OH reaction generated Fri Mar 16 12:48:56 2001 PST ! PR-BUAT : CH3-CH2-CH2-O-CO-CH2-CH2-CH3 ! K(OH) 7.410e-12 ! kOH for T=298 only. ! kOH from: Wallington et al (1988d). OHRR 0.489 ! RO2-R. OHNR 0.148 ! RO2-N. OHR2 0.513 ! R2O2. OHQ2 0.363 ! RCO-O2. OHCO 0.007 ! CO OHA1 0.001 ! HCHO OHA2 0.062 ! CCHO OHA3 0.062 ! RCHO OHK4 0.406 ! MEK OHK6 0.040 ! PROD2 OHBA 0.011 ! BACL OHMG 0.004 ! MGLY OHZ3 0.329 ! RCO-OH OHXC 1.797 ! C bal. calc. ! OH reaction generated Fri Mar 16 12:49:03 2001 PST ! BU-BUAT : CH3-CH2-CH2-CH2-O-CO-CH2-CH2-CH3 ! K(OH) 1.060e-11 ! kOH for T=298 only. ! kOH from: Wallington et al (1988d). OHRR 0.626 ! RO2-R. OHNR 0.216 ! RO2-N. OHR2 0.485 ! R2O2. OHQ2 0.158 ! RCO-O2. OHCO 0.006 ! CO OHA1 0.000 ! HCHO OHA2 0.104 ! CCHO OHA3 0.136 ! RCHO OHK4 0.313 ! MEK OHK6 0.202 ! PROD2 OHBA 0.007 ! BACL OHMG 0.003 ! MGLY OHZ3 0.147 ! RCO-OH OHXC 2.668 ! C bal. calc. ! OH reaction generated Fri Mar 16 12:49:16 2001 PST ! IBU-IBTR : CH3-CH(CH3)-CH2-O-CO-CH(CH3)-CH3 ! K(OH) 5.519e-12 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.692 ! RO2-R. OHNR 0.235 ! RO2-N. OHR2 0.916 ! R2O2. OHME 0.006 ! C-O2. OHQ2 0.067 ! RCO-O2. OHCO 0.208 ! CO OHA1 0.069 ! HCHO OHA2 0.002 ! CCHO OHA3 0.034 ! RCHO OHK3 0.660 ! ACET OHK4 0.466 ! MEK OHK6 0.003 ! PROD2 OHBA 0.003 ! BACL OHZ3 0.258 ! RCO-OH OHXC 1.358 ! C bal. calc. ! OH reaction generated Fri Mar 16 12:49:27 2001 PST ! NC6-ACET : CH3-CH2-CH2-CH2-CH2-CH2-O-CO-CH3 ! K(OH) 7.475e-12 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.683 ! RO2-R. OHNR 0.309 ! RO2-N. OHR2 0.805 ! R2O2. OHQ2 0.008 ! RCO-O2. OHA3 0.058 ! RCHO OHK6 0.647 ! PROD2 OHZ2 0.008 ! CCO-OH OHXC 2.053 ! C bal. calc. ! OH reaction generated Fri Mar 16 12:49:37 2001 PST ! 2MC5-ACT : CH3-CH2-CH2-CH(CH3)-CH2-O-CO-CH3 ! K(OH) 7.735e-12 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.704 ! RO2-R. OHNR 0.289 ! RO2-N. OHR2 0.906 ! R2O2. OHQ2 0.006 ! RCO-O2. OHCO 0.016 ! CO OHA1 0.002 ! HCHO OHA2 0.012 ! CCHO OHA3 0.436 ! RCHO OHK4 0.212 ! MEK OHK6 0.253 ! PROD2 OHZ2 0.023 ! CCO-OH OHXX 0.089 ! INERT OHXC 2.397 ! C bal. calc. ! OH reaction generated Fri Mar 16 12:49:54 2001 PST ! 3MC5-ACT : CH3-CH2-CH(CH3)-CH2-CH2-O-CO-CH3 ! K(OH) 7.735e-12 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.732 ! RO2-R. OHNR 0.259 ! RO2-N. OHR2 0.877 ! R2O2. OHQ2 0.010 ! RCO-O2. OHA1 0.001 ! HCHO OHA2 0.179 ! CCHO OHA3 0.386 ! RCHO OHK4 0.310 ! MEK OHK6 0.354 ! PROD2 OHZ2 0.010 ! CCO-OH OHXX 0.001 ! INERT OHXC 1.515 ! C bal. calc. ! OH reaction generated Fri Mar 16 12:50:14 2001 PST ! 4MC5-ACT : CH3-CH(CH3)-CH2-CH2-CH2-O-CO-CH3 ! K(OH) 7.454e-12 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.503 ! RO2-R. OHNR 0.294 ! RO2-N. OHR2 1.029 ! R2O2. OHQ2 0.203 ! RCO-O2. OHA1 0.005 ! HCHO OHA3 0.197 ! RCHO OHK3 0.145 ! ACET OHK4 0.178 ! MEK OHK6 0.139 ! PROD2 OHZ2 0.203 ! CCO-OH OHXX 0.010 ! INERT OHXC 2.633 ! C bal. calc. ! OH reaction generated Fri Mar 16 12:50:24 2001 PST ! 23MC4ACT : CH3-CH(CH3)-CH(CH3)-CH2-O-CO-CH3 ! K(OH) 7.714e-12 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.748 ! RO2-R. OHNR 0.247 ! RO2-N. OHR2 1.021 ! R2O2. OHQ2 0.005 ! RCO-O2. OHCO 0.009 ! CO OHA1 0.018 ! HCHO OHA2 0.184 ! CCHO OHA3 0.037 ! RCHO OHK3 0.717 ! ACET OHK4 0.549 ! MEK OHK6 0.006 ! PROD2 OHZ2 0.013 ! CCO-OH OHXX 0.200 ! INERT OHXC 1.391 ! C bal. calc. ! OH reaction generated Fri Mar 16 12:50:40 2001 PST ! NC7-ACET : CH3-CH2-CH2-CH2-CH2-CH2-CH2-O-CO-CH3 ! K(OH) 8.895e-12 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.624 ! RO2-R. OHNR 0.369 ! RO2-N. OHR2 0.797 ! R2O2. OHQ2 0.006 ! RCO-O2. OHA3 0.009 ! RCHO OHK6 0.615 ! PROD2 OHZ2 0.006 ! CCO-OH OHXC 3.034 ! C bal. calc. ! OH reaction generated Fri Mar 16 12:50:53 2001 PST ! 2MC6-ACT : CH3-CH2-CH2-CH2-CH(CH3)-CH2-O-CO-CH3 ! K(OH) 9.155e-12 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.631 ! RO2-R. OHNR 0.364 ! RO2-N. OHR2 0.922 ! R2O2. OHQ2 0.004 ! RCO-O2. OHCO 0.004 ! CO OHA1 0.001 ! HCHO OHA2 0.045 ! CCHO OHA3 0.143 ! RCHO OHK4 0.107 ! MEK OHK6 0.496 ! PROD2 OHZ2 0.008 ! CCO-OH OHXX 0.082 ! INERT OHXC 2.772 ! C bal. calc. ! OH reaction generated Fri Mar 16 12:51:15 2001 PST ! 3MC6-ACT : CH3-CH2-CH2-CH(CH3)-CH2-CH2-O-CO-CH3 ! K(OH) 9.155e-12 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.656 ! RO2-R. OHNR 0.338 ! RO2-N. OHR2 0.819 ! R2O2. OHQ2 0.006 ! RCO-O2. OHA1 0.001 ! HCHO OHA2 0.010 ! CCHO OHA3 0.301 ! RCHO OHK4 0.112 ! MEK OHK6 0.446 ! PROD2 OHZ2 0.006 ! CCO-OH OHXX 0.001 ! INERT OHXC 2.891 ! C bal. calc. ! OH reaction generated Fri Mar 16 12:51:42 2001 PST ! 4MC6-ACT : CH3-CH2-CH(CH3)-CH2-CH2-CH2-O-CO-CH3 ! K(OH) 9.155e-12 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.456 ! RO2-R. OHNR 0.359 ! RO2-N. OHR2 1.056 ! R2O2. OHQ2 0.185 ! RCO-O2. OHA1 0.001 ! HCHO OHA2 0.111 ! CCHO OHA3 0.133 ! RCHO OHK4 0.197 ! MEK OHK6 0.196 ! PROD2 OHZ2 0.185 ! CCO-OH OHXX 0.011 ! INERT OHXC 3.325 ! C bal. calc. ! OH reaction generated Fri Mar 16 12:52:10 2001 PST ! 5MC6-ACT : CH3-CH(CH3)-CH2-CH2-CH2-CH2-O-CO-CH3 ! K(OH) 8.874e-12 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.629 ! RO2-R. OHNR 0.365 ! RO2-N. OHR2 0.821 ! R2O2. OHQ2 0.006 ! RCO-O2. OHCO 0.005 ! CO OHA1 0.008 ! HCHO OHA3 0.089 ! RCHO OHK3 0.013 ! ACET OHK6 0.566 ! PROD2 OHZ2 0.011 ! CCO-OH OHXX 0.003 ! INERT OHXC 3.050 ! C bal. calc. ! OH reaction generated Fri Mar 16 12:52:23 2001 PST ! 3EC5-ACT : CH3-CH2-CH(CH2-CH3)-CH2-CH2-O-CO-CH3 ! K(OH) 9.560e-12 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.687 ! RO2-R. OHNR 0.309 ! RO2-N. OHR2 0.852 ! R2O2. OHQ2 0.004 ! RCO-O2. OHA1 0.001 ! HCHO OHA2 0.173 ! CCHO OHA3 0.338 ! RCHO OHK4 0.232 ! MEK OHK6 0.398 ! PROD2 OHZ2 0.004 ! CCO-OH OHXX 0.001 ! INERT OHXC 2.448 ! C bal. calc. ! OH reaction generated Fri Mar 16 12:52:50 2001 PST ! 24MC5ACT : CH3-CH(CH3)-CH2-CH(CH3)-CH2-O-CO-CH3 ! K(OH) 9.134e-12 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.587 ! RO2-R. OHNR 0.397 ! RO2-N. OHR2 1.291 ! R2O2. OHQ2 0.016 ! RCO-O2. OHCO 0.008 ! CO OHA1 0.153 ! HCHO OHA2 0.020 ! CCHO OHA3 0.267 ! RCHO OHK3 0.048 ! ACET OHK4 0.248 ! MEK OHK6 0.193 ! PROD2 OHZ2 0.024 ! CCO-OH OHXX 0.247 ! INERT OHXC 2.979 ! C bal. calc. ! OH reaction generated Fri Mar 16 12:53:16 2001 PST ! IC5IBUAT : CH3-CH(CH3)-CH2-CH2-O-CO-CH(CH3)-CH3 ! K(OH) 6.939e-12 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.591 ! RO2-R. OHNR 0.297 ! RO2-N. OHR2 0.842 ! R2O2. OHQ2 0.112 ! RCO-O2. OHA1 0.028 ! HCHO OHA2 0.000 ! CCHO OHA3 0.456 ! RCHO OHK3 0.435 ! ACET OHK4 0.033 ! MEK OHK6 0.122 ! PROD2 OHBA 0.002 ! BACL OHZ3 0.096 ! RCO-OH OHXC 3.020 ! C bal. calc. ! OH reaction generated Fri Mar 16 12:53:30 2001 PST ! NC8-ACET : CH3-CH2-CH2-CH2-CH2-CH2-CH2-CH2-O-CO-CH3 ! K(OH) 1.032e-11 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.585 ! RO2-R. OHNR 0.409 ! RO2-N. OHR2 0.784 ! R2O2. OHQ2 0.005 ! RCO-O2. OHA3 0.008 ! RCHO OHK6 0.577 ! PROD2 OHZ2 0.005 ! CCO-OH OHXC 4.030 ! C bal. calc. ! OH reaction generated Fri Mar 16 12:53:49 2001 PST ! 2ETHXACT : CH3-CH2-CH2-CH2-CH(CH2-CH3)-CH2-O-CO-CH3 ! K(OH) 1.098e-11 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.581 ! RO2-R. OHNR 0.415 ! RO2-N. OHR2 0.933 ! R2O2. OHQ2 0.003 ! RCO-O2. OHCO 0.003 ! CO OHA1 0.000 ! HCHO OHA2 0.096 ! CCHO OHA3 0.127 ! RCHO OHK4 0.075 ! MEK OHK6 0.477 ! PROD2 OHZ2 0.006 ! CCO-OH OHXX 0.063 ! INERT OHXC 3.689 ! C bal. calc. ! OH reaction generated Fri Mar 16 12:54:38 2001 PST ! 34MC6ACT : CH3-CH2-CH(CH3)-CH(CH3)-CH2-CH2-O-CO-CH3 ! K(OH) 1.083e-11 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.594 ! RO2-R. OHNR 0.374 ! RO2-N. OHR2 1.064 ! R2O2. OHQ2 0.031 ! RCO-O2. OHA1 0.008 ! HCHO OHA2 0.309 ! CCHO OHA3 0.109 ! RCHO OHK4 0.274 ! MEK OHK6 0.510 ! PROD2 OHZ2 0.031 ! CCO-OH OHXX 0.011 ! INERT OHXC 2.478 ! C bal. calc. ! OH reaction generated Fri Mar 16 12:56:15 2001 PST ! 35MC6ACT : CH3-CH(CH3)-CH2-CH(CH3)-CH2-CH2-O-CO-CH3 ! K(OH) 1.055e-11 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.576 ! RO2-R. OHNR 0.419 ! RO2-N. OHR2 1.103 ! R2O2. OHQ2 0.005 ! RCO-O2. OHA1 0.097 ! HCHO OHA2 0.014 ! CCHO OHA3 0.337 ! RCHO OHK3 0.041 ! ACET OHK4 0.008 ! MEK OHK6 0.484 ! PROD2 OHZ2 0.005 ! CCO-OH OHXX 0.000 ! INERT OHXC 3.263 ! C bal. calc. ! OH reaction generated Fri Mar 16 12:56:52 2001 PST ! 3EC6-ACT : CH3-CH2-CH2-CH(CH2-CH3)-CH2-CH2-O-CO-CH3 ! K(OH) 1.098e-11 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.624 ! RO2-R. OHNR 0.374 ! RO2-N. OHR2 0.820 ! R2O2. OHQ2 0.003 ! RCO-O2. OHA1 0.001 ! HCHO OHA2 0.043 ! CCHO OHA3 0.276 ! RCHO OHK6 0.546 ! PROD2 OHZ2 0.003 ! CCO-OH OHXX 0.001 ! INERT OHXC 3.551 ! C bal. calc. ! OH reaction generated Fri Mar 16 12:58:05 2001 PST ! 4MC7-ACT : CH3-CH2-CH2-CH(CH3)-CH2-CH2-CH2-O-CO-CH3 ! K(OH) 1.057e-11 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.444 ! RO2-R. OHNR 0.408 ! RO2-N. OHR2 0.984 ! R2O2. OHQ2 0.148 ! RCO-O2. OHA1 0.001 ! HCHO OHA2 0.001 ! CCHO OHA3 0.086 ! RCHO OHK4 0.114 ! MEK OHK6 0.309 ! PROD2 OHZ2 0.148 ! CCO-OH OHXX 0.009 ! INERT OHXC 4.232 ! C bal. calc. ! OH reaction generated Fri Mar 16 12:58:49 2001 PST ! 45MC6ACT : CH3-CH(CH3)-CH(CH3)-CH2-CH2-CH2-O-CO-CH3 ! K(OH) 1.055e-11 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.524 ! RO2-R. OHNR 0.397 ! RO2-N. OHR2 1.117 ! R2O2. OHQ2 0.079 ! RCO-O2. OHA1 0.005 ! HCHO OHA2 0.087 ! CCHO OHA3 0.134 ! RCHO OHK3 0.323 ! ACET OHK4 0.102 ! MEK OHK6 0.312 ! PROD2 OHZ2 0.079 ! CCO-OH OHXX 0.012 ! INERT OHXC 3.371 ! C bal. calc. ! OH reaction generated Fri Mar 16 12:59:29 2001 PST ! 5MC7-ACT : CH3-CH2-CH(CH3)-CH2-CH2-CH2-CH2-O-CO-CH3 ! K(OH) 1.057e-11 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.585 ! RO2-R. OHNR 0.409 ! RO2-N. OHR2 0.836 ! R2O2. OHQ2 0.005 ! RCO-O2. OHCO 0.005 ! CO OHA1 0.001 ! HCHO OHA2 0.044 ! CCHO OHA3 0.058 ! RCHO OHK4 0.012 ! MEK OHK6 0.544 ! PROD2 OHZ2 0.010 ! CCO-OH OHXX 0.003 ! INERT OHXC 3.929 ! C bal. calc. ! OH reaction generated Fri Mar 16 13:00:21 2001 PST ! 3MC7-ACT : CH3-CH2-CH2-CH2-CH(CH3)-CH2-CH2-O-CO-CH3 ! K(OH) 1.057e-11 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.583 ! RO2-R. OHNR 0.412 ! RO2-N. OHR2 0.843 ! R2O2. OHQ2 0.005 ! RCO-O2. OHA1 0.001 ! HCHO OHA2 0.034 ! CCHO OHA3 0.079 ! RCHO OHK6 0.561 ! PROD2 OHZ2 0.005 ! CCO-OH OHXX 0.000 ! INERT OHXC 3.834 ! C bal. calc. ! OH reaction generated Fri Mar 16 13:01:06 2001 PST ! 24MC6ACT : CH3-CH2-CH(CH3)-CH2-CH(CH3)-CH2-O-CO-CH3 ! K(OH) 1.083e-11 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.506 ! RO2-R. OHNR 0.480 ! RO2-N. OHR2 1.388 ! R2O2. OHQ2 0.014 ! RCO-O2. OHCO 0.003 ! CO OHA1 0.012 ! HCHO OHA2 0.286 ! CCHO OHA3 0.132 ! RCHO OHK4 0.173 ! MEK OHK6 0.297 ! PROD2 OHZ2 0.017 ! CCO-OH OHXX 0.271 ! INERT OHXC 3.319 ! C bal. calc. ! OH reaction generated Fri Mar 16 13:02:08 2001 PST ! NC9-ACET : CH3-CH2-CH2-CH2-CH2-CH2-CH2-CH2-CH2-O-CO-CH3 ! K(OH) 1.174e-11 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.561 ! RO2-R. OHNR 0.435 ! RO2-N. OHR2 0.777 ! R2O2. OHQ2 0.004 ! RCO-O2. OHA3 0.007 ! RCHO OHK6 0.554 ! PROD2 OHZ2 0.004 ! CCO-OH OHXC 5.025 ! C bal. calc. ! OH reaction generated Fri Mar 16 13:02:32 2001 PST ! 2MC8-ACT : CH3-CH2-CH2-CH2-CH2-CH2-CH(CH3)-CH2-O-CO-CH3 ! K(OH) 1.199e-11 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.538 ! RO2-R. OHNR 0.459 ! RO2-N. OHR2 0.931 ! R2O2. OHQ2 0.003 ! RCO-O2. OHCO 0.002 ! CO OHA1 0.000 ! HCHO OHA2 0.002 ! CCHO OHA3 0.077 ! RCHO OHK4 0.041 ! MEK OHK6 0.476 ! PROD2 OHZ2 0.005 ! CCO-OH OHXX 0.042 ! INERT OHXC 4.929 ! C bal. calc. ! OH reaction generated Fri Mar 16 13:03:11 2001 PST ! 4MC8-ACT : CH3-CH2-CH2-CH2-CH(CH3)-CH2-CH2-CH2-O-CO-CH3 ! K(OH) 1.199e-11 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.470 ! RO2-R. OHNR 0.439 ! RO2-N. OHR2 0.919 ! R2O2. OHQ2 0.091 ! RCO-O2. OHA1 0.000 ! HCHO OHA2 0.010 ! CCHO OHA3 0.064 ! RCHO OHK6 0.455 ! PROD2 OHZ2 0.091 ! CCO-OH OHXX 0.005 ! INERT OHXC 4.966 ! C bal. calc. ! OH reaction generated Fri Mar 16 13:04:12 2001 PST ! 5MC8-ACT : CH3-CH2-CH2-CH(CH3)-CH2-CH2-CH2-CH2-O-CO-CH3 ! K(OH) 1.199e-11 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.559 ! RO2-R. OHNR 0.437 ! RO2-N. OHR2 0.831 ! R2O2. OHQ2 0.004 ! RCO-O2. OHCO 0.004 ! CO OHA1 0.000 ! HCHO OHA2 0.001 ! CCHO OHA3 0.087 ! RCHO OHK4 0.003 ! MEK OHK6 0.531 ! PROD2 OHZ2 0.008 ! CCO-OH OHXX 0.002 ! INERT OHXC 4.884 ! C bal. calc. ! OH reaction generated Fri Mar 16 13:05:09 2001 PST ! 3EC7-ACT : CH3-CH2-CH2-CH2-CH(CH2-CH3)-CH2-CH2-O-CO-CH3 ! K(OH) 1.240e-11 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.556 ! RO2-R. OHNR 0.442 ! RO2-N. OHR2 0.849 ! R2O2. OHQ2 0.002 ! RCO-O2. OHA1 0.000 ! HCHO OHA2 0.049 ! CCHO OHA3 0.074 ! RCHO OHK6 0.536 ! PROD2 OHZ2 0.002 ! CCO-OH OHXX 0.000 ! INERT OHXC 4.800 ! C bal. calc. ! OH reaction generated Fri Mar 16 13:06:44 2001 PST ! 36MC7ACT : CH3-CH(CH3)-CH2-CH2-CH(CH3)-CH2-CH2-O-CO-CH3 ! K(OH) 1.197e-11 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.519 ! RO2-R. OHNR 0.477 ! RO2-N. OHR2 1.160 ! R2O2. OHQ2 0.004 ! RCO-O2. OHA1 0.012 ! HCHO OHA2 0.006 ! CCHO OHA3 0.251 ! RCHO OHK3 0.148 ! ACET OHK6 0.494 ! PROD2 OHZ2 0.004 ! CCO-OH OHXX 0.000 ! INERT OHXC 3.934 ! C bal. calc. ! OH reaction generated Fri Mar 16 13:07:29 2001 PST ! 35MC7ACT : CH3-CH2-CH(CH3)-CH2-CH(CH3)-CH2-CH2-O-CO-CH3 ! K(OH) 1.225e-11 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.492 ! RO2-R. OHNR 0.504 ! RO2-N. OHR2 1.242 ! R2O2. OHQ2 0.004 ! RCO-O2. OHA1 0.005 ! HCHO OHA2 0.227 ! CCHO OHA3 0.266 ! RCHO OHK4 0.012 ! MEK OHK6 0.451 ! PROD2 OHZ2 0.004 ! CCO-OH OHXX 0.000 ! INERT OHXC 3.941 ! C bal. calc. ! OH reaction generated Fri Mar 16 13:08:56 2001 PST ! 45MC7ACT : CH3-CH2-CH(CH3)-CH(CH3)-CH2-CH2-CH2-O-CO-CH3 ! K(OH) 1.225e-11 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.522 ! RO2-R. OHNR 0.431 ! RO2-N. OHR2 1.136 ! R2O2. OHQ2 0.047 ! RCO-O2. OHA1 0.003 ! HCHO OHA2 0.210 ! CCHO OHA3 0.080 ! RCHO OHK4 0.235 ! MEK OHK6 0.472 ! PROD2 OHZ2 0.047 ! CCO-OH OHXX 0.010 ! INERT OHXC 3.736 ! C bal. calc. ! OH reaction generated Fri Mar 16 13:11:12 2001 PST ! 46MC7ACT : CH3-CH(CH3)-CH2-CH(CH3)-CH2-CH2-CH2-O-CO-CH3 ! K(OH) 1.197e-11 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.425 ! RO2-R. OHNR 0.452 ! RO2-N. OHR2 1.123 ! R2O2. OHQ2 0.123 ! RCO-O2. OHA1 0.037 ! HCHO OHA2 0.009 ! CCHO OHA3 0.178 ! RCHO OHK3 0.022 ! ACET OHK4 0.007 ! MEK OHK6 0.374 ! PROD2 OHZ2 0.123 ! CCO-OH OHXX 0.007 ! INERT OHXC 4.739 ! C bal. calc. ! OH reaction generated Fri Mar 16 13:12:07 2001 PST ! 24MC7ACT : CH3-CH2-CH2-CH(CH3)-CH2-CH(CH3)-CH2-O-CO-CH3 ! K(OH) 1.225e-11 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.480 ! RO2-R. OHNR 0.508 ! RO2-N. OHR2 1.282 ! R2O2. OHQ2 0.012 ! RCO-O2. OHCO 0.001 ! CO OHA1 0.008 ! HCHO OHA2 0.003 ! CCHO OHA3 0.303 ! RCHO OHK4 0.045 ! MEK OHK6 0.411 ! PROD2 OHZ2 0.013 ! CCO-OH OHXX 0.229 ! INERT OHXC 4.089 ! C bal. calc. ! OH reaction generated Fri Mar 16 13:13:33 2001 PST ! 23MC7ACT : CH3-CH2-CH2-CH2-CH(CH3)-CH(CH3)-CH2-O-CO-CH3 ! K(OH) 1.225e-11 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.569 ! RO2-R. OHNR 0.429 ! RO2-N. OHR2 1.066 ! R2O2. OHQ2 0.002 ! RCO-O2. OHCO 0.007 ! CO OHA1 0.002 ! HCHO OHA2 0.068 ! CCHO OHA3 0.071 ! RCHO OHK4 0.289 ! MEK OHK6 0.528 ! PROD2 OHZ2 0.009 ! CCO-OH OHXX 0.089 ! INERT OHXC 3.631 ! C bal. calc. ! OH reaction generated Fri Mar 16 13:15:19 2001 PST ! 25MC7ACT : CH3-CH2-CH(CH3)-CH2-CH2-CH(CH3)-CH2-O-CO-CH3 ! K(OH) 1.225e-11 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.534 ! RO2-R. OHNR 0.463 ! RO2-N. OHR2 1.235 ! R2O2. OHQ2 0.003 ! RCO-O2. OHCO 0.032 ! CO OHA1 0.003 ! HCHO OHA2 0.162 ! CCHO OHA3 0.089 ! RCHO OHK4 0.217 ! MEK OHK6 0.450 ! PROD2 OHZ2 0.035 ! CCO-OH OHXX 0.107 ! INERT OHXC 3.840 ! C bal. calc. ! OH reaction generated Fri Mar 16 13:16:18 2001 PST ! 235M6ACT : CH3-CH(CH3)-CH2-CH(CH3)-CH(CH3)-CH2-O-CO-CH3 ! K(OH) 1.223e-11 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.541 ! RO2-R. OHNR 0.457 ! RO2-N. OHR2 1.288 ! R2O2. OHQ2 0.002 ! RCO-O2. OHCO 0.007 ! CO OHA1 0.040 ! HCHO OHA2 0.063 ! CCHO OHA3 0.058 ! RCHO OHK3 0.063 ! ACET OHK4 0.376 ! MEK OHK6 0.484 ! PROD2 OHZ2 0.009 ! CCO-OH OHXX 0.131 ! INERT OHXC 3.162 ! C bal. calc. ! OH reaction generated Fri Mar 16 13:17:53 2001 PST ! 36MC8ACT : CH3-CH2-CH(CH3)-CH2-CH2-CH(CH3)-CH2-CH2-O-CO-CH3 ! K(OH) 1.367e-11 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.522 ! RO2-R. OHNR 0.474 ! RO2-N. OHR2 1.101 ! R2O2. OHQ2 0.004 ! RCO-O2. OHA1 0.002 ! HCHO OHA2 0.107 ! CCHO OHA3 0.187 ! RCHO OHK4 0.071 ! MEK OHK6 0.514 ! PROD2 OHZ2 0.004 ! CCO-OH OHXX 0.000 ! INERT OHXC 4.987 ! C bal. calc. ! OH reaction generated Fri Mar 16 13:19:22 2001 PST ! 46MC8ACT : CH3-CH2-CH(CH3)-CH2-CH(CH3)-CH2-CH2-CH2-O-CO-CH3 ! K(OH) 1.367e-11 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.429 ! RO2-R. OHNR 0.495 ! RO2-N. OHR2 1.158 ! R2O2. OHQ2 0.076 ! RCO-O2. OHA1 0.003 ! HCHO OHA2 0.136 ! CCHO OHA3 0.194 ! RCHO OHK4 0.013 ! MEK OHK6 0.395 ! PROD2 OHZ2 0.076 ! CCO-OH OHXX 0.004 ! INERT OHXC 5.371 ! C bal. calc. ! OH reaction generated Fri Mar 16 13:21:37 2001 PST ! 3IPC7ACT : CH3-CH2-CH2-CH2-CH(CH(CH3)-CH3)-CH2-CH2-O-CO-CH3 ! K(OH) 1.380e-11 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.548 ! RO2-R. OHNR 0.449 ! RO2-N. OHR2 0.958 ! R2O2. OHQ2 0.003 ! RCO-O2. OHA1 0.001 ! HCHO OHA2 0.012 ! CCHO OHA3 0.117 ! RCHO OHK3 0.247 ! ACET OHK4 0.000 ! MEK OHK6 0.503 ! PROD2 OHZ2 0.003 ! CCO-OH OHXX 0.000 ! INERT OHXC 5.160 ! C bal. calc. ! OH reaction generated Fri Mar 16 13:23:36 2001 PST ! 47MC9ACT : CH3-CH2-CH(CH3)-CH2-CH2-CH(CH3)-CH2-CH2-CH2-O-CO-CH3 ! K(OH) 1.510e-11 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.384 ! RO2-R. OHNR 0.502 ! RO2-N. OHR2 1.120 ! R2O2. OHQ2 0.114 ! RCO-O2. OHA1 0.001 ! HCHO OHA2 0.055 ! CCHO OHA3 0.083 ! RCHO OHK4 0.044 ! MEK OHK6 0.353 ! PROD2 OHZ2 0.114 ! CCO-OH OHXX 0.006 ! INERT OHXC 6.757 ! C bal. calc. ! OH reaction generated Fri Mar 16 13:25:45 2001 PST ! 357M8ACT : CH3-CH(CH3)-CH2-CH(CH3)-CH2-CH(CH3)-CH2-CH2-O-CO-CH3 ! K(OH) 1.507e-11 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.463 ! RO2-R. OHNR 0.534 ! RO2-N. OHR2 1.185 ! R2O2. OHQ2 0.003 ! RCO-O2. OHA1 0.008 ! HCHO OHA2 0.006 ! CCHO OHA3 0.368 ! RCHO OHK3 0.041 ! ACET OHK4 0.001 ! MEK OHK6 0.394 ! PROD2 OHZ2 0.003 ! CCO-OH OHXX 0.000 ! INERT OHXC 6.168 ! C bal. calc. ! OH reaction generated Fri Mar 16 13:28:13 2001 PST ! 3E6M8ACT : CH3-CH2-CH(CH3)-CH2-CH2-CH(CH2-CH3)-CH2-CH2-O-CO-CH3 ! K(OH) 1.550e-11 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.507 ! RO2-R. OHNR 0.491 ! RO2-N. OHR2 1.092 ! R2O2. OHQ2 0.002 ! RCO-O2. OHA1 0.001 ! HCHO OHA2 0.137 ! CCHO OHA3 0.139 ! RCHO OHK4 0.072 ! MEK OHK6 0.501 ! PROD2 OHZ2 0.002 ! CCO-OH OHXX 0.000 ! INERT OHXC 6.061 ! C bal. calc. ! OH reaction generated Fri Mar 16 13:31:59 2001 PST ! 368M9ACT : CH3-CH(CH3)-CH2-CH(CH3)-CH2-CH2-CH(CH3)-CH2-CH2-O-CO-CH3 ! K(OH) 1.649e-11 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.477 ! RO2-R. OHNR 0.520 ! RO2-N. OHR2 1.132 ! R2O2. OHQ2 0.003 ! RCO-O2. OHA1 0.039 ! HCHO OHA2 0.005 ! CCHO OHA3 0.218 ! RCHO OHK3 0.022 ! ACET OHK4 0.001 ! MEK OHK6 0.464 ! PROD2 OHZ2 0.003 ! CCO-OH OHXX 0.000 ! INERT OHXC 7.313 ! C bal. calc. ! OH reaction generated Fri Mar 16 13:34:59 2001 PST ! 357M9ACT : CH3-CH2-CH(CH3)-CH2-CH(CH3)-CH2-CH(CH3)-CH2-CH2-O-CO-CH3 ! K(OH) 1.677e-11 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.451 ! RO2-R. OHNR 0.546 ! RO2-N. OHR2 1.181 ! R2O2. OHQ2 0.003 ! RCO-O2. OHA1 0.002 ! HCHO OHA2 0.089 ! CCHO OHA3 0.285 ! RCHO OHK4 0.030 ! MEK OHK6 0.384 ! PROD2 OHZ2 0.003 ! CCO-OH OHXX 0.000 ! INERT OHXC 7.258 ! C bal. calc. ! OH reaction generated Fri Mar 16 13:39:16 2001 PST ! 2357M8AC : CH3-CH(CH3)-CH2-CH(CH3)-CH2-CH(CH3)-CH(CH3)-CH2-O-CO-CH3 ! K(OH) 1.675e-11 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.466 ! RO2-R. OHNR 0.533 ! RO2-N. OHR2 1.267 ! R2O2. OHQ2 0.001 ! RCO-O2. OHCO 0.005 ! CO OHA1 0.021 ! HCHO OHA2 0.047 ! CCHO OHA3 0.166 ! RCHO OHK3 0.016 ! ACET OHK4 0.281 ! MEK OHK6 0.426 ! PROD2 OHZ2 0.007 ! CCO-OH OHXX 0.076 ! INERT OHXC 6.366 ! C bal. calc. ! OH reaction generated Fri Mar 16 13:44:34 2001 PST ! 2468M8AC : CH3-CH(CH3)-CH2-CH(CH3)-CH2-CH(CH3)-CH2-CH(CH3)-CH2-O-CO-CH3 ! K(OH) 1.817e-11 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.441 ! RO2-R. OHNR 0.554 ! RO2-N. OHR2 1.209 ! R2O2. OHQ2 0.006 ! RCO-O2. OHCO 0.002 ! CO OHA1 0.008 ! HCHO OHA2 0.005 ! CCHO OHA3 0.251 ! RCHO OHK3 0.020 ! ACET OHK4 0.068 ! MEK OHK6 0.341 ! PROD2 OHZ2 0.008 ! CCO-OH OHXX 0.072 ! INERT OHXC 8.425 ! C bal. calc. ! OH reaction generated Fri Mar 16 13:48:36 2001 PST ! 479M10AC : CH3-CH(CH3)-CH2-CH(CH3)-CH2-CH2-CH(CH3)-CH2-CH2-CH2-O-CO-CH3 ! K(OH) 1.791e-11 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.375 ! RO2-R. OHNR 0.531 ! RO2-N. OHR2 1.148 ! R2O2. OHQ2 0.094 ! RCO-O2. OHA1 0.025 ! HCHO OHA2 0.001 ! CCHO OHA3 0.106 ! RCHO OHK3 0.016 ! ACET OHK4 0.001 ! MEK OHK6 0.352 ! PROD2 OHZ2 0.094 ! CCO-OH OHXX 0.005 ! INERT OHXC 8.828 ! C bal. calc. ! OH reaction generated Fri Mar 16 13:51:49 2001 PST ! 3E67M9AC : CH3-CH2-CH(CH3)-CH(CH3)-CH2-CH2-CH(CH2-CH3)-CH2-CH2-O-CO-CH3 ! K(OH) 1.860e-11 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.501 ! RO2-R. OHNR 0.498 ! RO2-N. OHR2 1.130 ! R2O2. OHQ2 0.002 ! RCO-O2. OHA1 0.000 ! HCHO OHA2 0.191 ! CCHO OHA3 0.077 ! RCHO OHK4 0.197 ! MEK OHK6 0.504 ! PROD2 OHZ2 0.002 ! CCO-OH OHXX 0.000 ! INERT OHXC 7.581 ! C bal. calc. ! OH reaction generated Fri Mar 16 13:56:14 2001 PST ! 3579M10A : CH3-CH(CH3)-CH2-CH(CH3)-CH2-CH(CH3)-CH2-CH(CH3)-CH2-CH2-O-CO-CH3 ! K(OH) 1.959e-11 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.439 ! RO2-R. OHNR 0.558 ! RO2-N. OHR2 1.149 ! R2O2. OHQ2 0.003 ! RCO-O2. OHA1 0.006 ! HCHO OHA2 0.005 ! CCHO OHA3 0.220 ! RCHO OHK3 0.021 ! ACET OHK4 0.000 ! MEK OHK6 0.407 ! PROD2 OHZ2 0.003 ! CCO-OH OHXX 0.000 ! INERT OHXC 9.461 ! C bal. calc. ! OH reaction generated Fri Mar 16 14:01:15 2001 PST ! 5E368M9A : CH3-CH(CH3)-CH2-CH(CH3)-CH(CH2-CH3)-CH2-CH(CH3)-CH2-CH2-O-CO-CH3 ! K(OH) 2.000e-11 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.427 ! RO2-R. OHNR 0.570 ! RO2-N. OHR2 1.315 ! R2O2. OHQ2 0.003 ! RCO-O2. OHA1 0.018 ! HCHO OHA2 0.062 ! CCHO OHA3 0.146 ! RCHO OHK3 0.024 ! ACET OHK4 0.008 ! MEK OHK6 0.672 ! PROD2 OHZ2 0.003 ! CCO-OH OHXX 0.000 ! INERT OHXC 7.854 ! C bal. calc. ! OH reaction generated Fri Mar 16 14:11:26 2001 PST ! 23568M9A : CH3-CH(CH3)-CH2-CH(CH3)-CH(CH3)-CH2-CH(CH3)-CH(CH3)-CH2-O-CO-CH3 ! K(OH) 1.985e-11 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.447 ! RO2-R. OHNR 0.552 ! RO2-N. OHR2 1.360 ! R2O2. OHQ2 0.001 ! RCO-O2. OHCO 0.005 ! CO OHA1 0.017 ! HCHO OHA2 0.037 ! CCHO OHA3 0.077 ! RCHO OHK3 0.028 ! ACET OHK4 0.233 ! MEK OHK6 0.650 ! PROD2 OHZ2 0.006 ! CCO-OH OHXX 0.048 ! INERT OHXC 7.381 ! C bal. calc. ! OH reaction generated Fri Mar 16 14:19:13 2001 PST ! DMC : CH3-O-CO-O-CH3 ! K(OH) 3.300e-13 ! kOH for T=298 only. ! kOH from: Sidebottom et al (1997). OHRR 1.000 ! RO2-R. OHCO 0.400 ! CO OHZ3 0.400 ! RCO-OH OHXX 0.600 ! INERT OHXC 0.800 ! C bal. calc. ! OH reaction generated Fri Mar 16 14:19:16 2001 PST ! PC : *CH(CH3)-CH2-O-CO-O-* ! K(OH) 6.900e-13 0.000 0.00 ! kOH from: Carter et al (1996c). OHRR 0.630 ! RO2-R. OHNR 0.021 ! RO2-N. OHR2 1.507 ! R2O2. OHQ1 0.349 ! CCO-O2. OHCO 0.377 ! CO OHA1 0.213 ! HCHO OHA3 0.034 ! RCHO OHZ3 0.725 ! RCO-OH OHXX 0.220 ! INERT OHXC 0.090 ! C bal. calc. ! OH reaction generated Fri Mar 16 14:19:21 2001 PST ! ME-LACT : CH3-CH(OH)-CO-O-CH3 ! K(OH) 2.760e-12 ! kOH for T=298 only. ! kOH from: Atkinson and Carter (1995). OHRH 0.835 ! HO2. OHRR 0.153 ! RO2-R. OHNR 0.006 ! RO2-N. OHQ2 0.005 ! RCO-O2. OHCO 0.047 ! CO OHA1 0.061 ! HCHO OHA2 0.005 ! CCHO OHK4 0.024 ! MEK OHK6 0.047 ! PROD2 OHBA 0.857 ! BACL OHMG 0.061 ! MGLY OHXC -0.157 ! C bal. calc. ! OH reaction generated Fri Mar 16 14:19:23 2001 PST ! ET-LACT : CH3-CH(OH)-CO-O-CH2-CH3 ! K(OH) 3.910e-12 ! kOH for T=298 only. ! kOH from: Atkinson and Carter (1995). OHRH 0.183 ! HO2. OHRR 0.452 ! RO2-R. OHNR 0.031 ! RO2-N. OHQ1 0.333 ! CCO-O2. OHQ2 0.001 ! RCO-O2. OHA1 0.039 ! HCHO OHA2 0.001 ! CCHO OHA3 0.039 ! RCHO OHK4 0.017 ! MEK OHK6 0.333 ! PROD2 OHBA 0.541 ! BACL OHMG 0.039 ! MGLY OHXC -0.355 ! C bal. calc. ! OH reaction generated Fri Mar 16 14:19:26 2001 PST ! MCSVACET : CH3-O-CH2-CH2-O-CO-CH3 ! K(OH) 1.261e-11 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.811 ! RO2-R. OHNR 0.077 ! RO2-N. OHR2 0.856 ! R2O2. OHQ2 0.112 ! RCO-O2. OHCO 0.456 ! CO OHA1 0.004 ! HCHO OHA3 0.003 ! RCHO OHK4 0.077 ! MEK OHK6 0.018 ! PROD2 OHZ2 0.567 ! CCO-OH OHXX 0.981 ! INERT OHXC 1.202 ! C bal. calc. ! OH reaction generated Fri Mar 16 14:19:30 2001 PST ! MIPR-CB : CH3-CH(CH3)-O-CO-O-CH3 ! K(OH) 2.550e-12 ! kOH for T=298 only. ! kOH from: Carter et al (unpublished results, 1999) OHRR 0.302 ! RO2-R. OHNR 0.047 ! RO2-N. OHR2 0.707 ! R2O2. OHME 0.599 ! C-O2. OHQ1 0.051 ! CCO-O2. OHCO 0.038 ! CO OHC2 0.209 ! CO2 OHA1 0.265 ! HCHO OHA3 0.033 ! RCHO OHK3 0.209 ! ACET OHK4 0.020 ! MEK OHZ3 0.090 ! RCO-OH OHXX 0.601 ! INERT OHXC 1.827 ! C bal. calc. ! OH reaction generated Fri Mar 16 14:19:34 2001 PST ! 2PGMEACT : CH3-O-CH(CH3)-CH2-O-CO-CH3 ! K(OH) 2.296e-11 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.827 ! RO2-R. OHNR 0.110 ! RO2-N. OHR2 0.930 ! R2O2. OHME 0.060 ! C-O2. OHQ2 0.003 ! RCO-O2. OHCO 0.501 ! CO OHA1 0.011 ! HCHO OHA2 0.011 ! CCHO OHK4 0.043 ! MEK OHK6 0.001 ! PROD2 OHZ1 0.001 ! HCOOH OHZ2 0.504 ! CCO-OH OHXX 1.191 ! INERT OHXC 2.360 ! C bal. calc. ! OH reaction generated Fri Mar 16 14:19:39 2001 PST ! CSV-ACET : CH3-CH2-O-CH2-CH2-O-CO-CH3 ! K(OH) 1.943e-11 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.570 ! RO2-R. OHNR 0.111 ! RO2-N. OHR2 0.842 ! R2O2. OHME 0.288 ! C-O2. OHQ2 0.031 ! RCO-O2. OHCO 0.288 ! CO OHA1 0.003 ! HCHO OHA2 0.058 ! CCHO OHA3 0.055 ! RCHO OHK4 0.745 ! MEK OHK6 0.060 ! PROD2 OHZ2 0.319 ! CCO-OH OHXX 0.162 ! INERT OHXC 0.235 ! C bal. calc. ! OH reaction generated Fri Mar 16 14:19:44 2001 PST ! PGME-ACT : CH3-O-CH2-CH(CH3)-O-CO-CH3 ! K(OH) 1.440e-11 ! kOH for T=298 only. ! kOH from: Carter et al (1999a) OHRR 0.328 ! RO2-R. OHNR 0.127 ! RO2-N. OHR2 1.398 ! R2O2. OHQ1 0.538 ! CCO-O2. OHQ2 0.007 ! RCO-O2. OHA1 0.032 ! HCHO OHA3 0.001 ! RCHO OHK4 0.049 ! MEK OHK6 0.050 ! PROD2 OHZ1 0.000 ! HCOOH OHZ2 0.545 ! CCO-OH OHXX 1.005 ! INERT OHXC 1.511 ! C bal. calc. ! OH reaction generated Fri Mar 16 14:19:52 2001 PST ! DBE-4 : CH3-O-CO-CH2-CH2-CO-O-CH3 ! K(OH) 1.500e-12 ! kOH for T=298 only. ! kOH from: Carter et al (1997e). OHRR 0.901 ! RO2-R. OHNR 0.083 ! RO2-N. OHR2 0.051 ! R2O2. OHQ2 0.016 ! RCO-O2. OHCO 0.533 ! CO OHA3 0.016 ! RCHO OHK4 0.297 ! MEK OHK6 0.004 ! PROD2 OHBA 0.071 ! BACL OHZ3 0.529 ! RCO-OH OHXC 1.790 ! C bal. calc. ! OH reaction generated Fri Mar 16 14:19:57 2001 PST ! ETGLDACT : CH3-CO-O-CH2-CH2-O-CO-CH3 ! K(OH) 3.775e-12 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.075 ! RO2-R. OHNR 0.100 ! RO2-N. OHR2 0.858 ! R2O2. OHQ2 0.826 ! RCO-O2. OHCO 0.009 ! CO OHK4 0.058 ! MEK OHMG 0.003 ! MGLY OHZ2 0.820 ! CCO-OH OHZ3 0.015 ! RCO-OH OHXX 0.018 ! INERT OHXC 0.972 ! C bal. calc. ! OH reaction generated Fri Mar 16 14:20:00 2001 PST ! E3EOC3OH : CH3-CH2-O-CH2-CH2-CO-O-CH2-CH3 ! K(OH) 1.957e-11 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.407 ! RO2-R. OHNR 0.159 ! RO2-N. OHR2 0.985 ! R2O2. OHME 0.278 ! C-O2. OHQ1 0.157 ! CCO-O2. OHA1 0.002 ! HCHO OHA2 0.058 ! CCHO OHA3 0.056 ! RCHO OHK4 0.730 ! MEK OHK6 0.079 ! PROD2 OHBA 0.001 ! BACL OHMG 0.315 ! MGLY OHZ3 0.091 ! RCO-OH OHXC 0.557 ! C bal. calc. ! OH reaction generated Fri Mar 16 14:20:07 2001 PST ! DIPR-CB : CH3-CH(CH3)-O-CO-O-CH(CH3)-CH3 ! K(OH) 6.877e-12 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.252 ! RO2-R. OHNR 0.139 ! RO2-N. OHR2 0.647 ! R2O2. OHME 0.577 ! C-O2. OHQ1 0.032 ! CCO-O2. OHC2 0.202 ! CO2 OHA1 0.038 ! HCHO OHA3 0.048 ! RCHO OHK3 0.403 ! ACET OHK4 0.579 ! MEK OHZ3 0.032 ! RCO-OH OHXC 1.519 ! C bal. calc. ! OH reaction generated Fri Mar 16 14:20:11 2001 PST ! DBE-5 : CH3-O-CO-CH2-CH2-CH2-CO-O-CH3 ! K(OH) 3.500e-12 ! kOH for T=298 only. ! kOH from: Carter et al (1997e). OHRR 0.828 ! RO2-R. OHNR 0.172 ! RO2-N. OHR2 0.164 ! R2O2. OHCO 0.273 ! CO OHK4 0.499 ! MEK OHK6 0.273 ! PROD2 OHBA 0.056 ! BACL OHXC 1.836 ! C bal. calc. ! OH reaction generated Fri Mar 16 14:20:18 2001 PST ! 2BUETACT : CH3-CH2-CH2-CH2-O-CH2-CH2-O-CO-CH3 ! K(OH) 2.378e-11 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.776 ! RO2-R. OHNR 0.205 ! RO2-N. OHR2 0.897 ! R2O2. OHQ2 0.019 ! RCO-O2. OHCO 0.246 ! CO OHA1 0.000 ! HCHO OHA2 0.017 ! CCHO OHA3 0.366 ! RCHO OHK4 0.674 ! MEK OHK6 0.114 ! PROD2 OHZ2 0.265 ! CCO-OH OHXX 0.135 ! INERT OHXC 1.290 ! C bal. calc. ! OH reaction generated Fri Mar 16 14:20:30 2001 PST ! DBE-6 : CH3-O-CO-CH2-CH2-CH2-CH2-CO-O-CH3 ! K(OH) 8.800e-12 ! kOH for T=298 only. ! kOH from: Carter et al (1997e). OHRR 0.783 ! RO2-R. OHNR 0.217 ! RO2-N. OHR2 0.620 ! R2O2. OHCO 0.062 ! CO OHA3 0.879 ! RCHO OHK4 0.157 ! MEK OHK6 0.059 ! PROD2 OHBA 0.125 ! BACL OHMG 0.020 ! MGLY OHZ3 0.003 ! RCO-OH OHXC 2.447 ! C bal. calc. ! OH reaction generated Fri Mar 16 14:20:37 2001 PST ! TEXANOL1 : CH3-CH(CH3)-CH(OH)-C(CH3)(CH3)-CH2-O-CO-CH(CH3)-CH3 ! K(OH) 1.620e-11 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRH 0.439 ! HO2. OHRR 0.430 ! RO2-R. OHNR 0.126 ! RO2-N. OHME 0.000 ! C-O2. OHQ2 0.004 ! RCO-O2. OHCO 0.005 ! CO OHA1 0.034 ! HCHO OHA2 0.010 ! CCHO OHA3 0.244 ! RCHO OHK3 0.218 ! ACET OHK4 0.117 ! MEK OHK6 0.628 ! PROD2 OHBA 0.001 ! BACL OHZ3 0.005 ! RCO-OH OHXC 5.532 ! C bal. calc. ! OH reaction generated Fri Mar 16 14:21:01 2001 PST ! TEXANOL2 : CH3-CH(CH3)-CO-O-CH(CH(CH3)-CH3)-C(CH3)(CH3)-CH2-OH ! K(OH) 1.288e-11 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.755 ! RO2-R. OHNR 0.242 ! RO2-N. OHR2 0.177 ! R2O2. OHQ2 0.003 ! RCO-O2. OHA1 0.362 ! HCHO OHA2 0.001 ! CCHO OHA3 0.437 ! RCHO OHK3 0.361 ! ACET OHK4 0.346 ! MEK OHK6 0.009 ! PROD2 OHBA 0.000 ! BACL OHZ3 0.001 ! RCO-OH OHXC 6.341 ! C bal. calc. ! OH reaction generated Fri Mar 16 14:21:36 2001 PST ! ETOX : *CH2-CH2-O-* ! K(OH) 7.600e-14 ! kOH for T=298 only. ! kOH from: Atkinson (1989) OHRR 1.000 ! RO2-R. OHR2 1.000 ! R2O2. OHCO 0.657 ! CO OHC2 0.041 ! CO2 OHA1 0.041 ! HCHO OHZ1 0.657 ! HCOOH OHXX 0.302 ! INERT OHXC 0.302 ! C bal. calc. ! OH reaction generated Fri Mar 16 14:21:38 2001 PST ! PROX : *CH(CH3)-CH2-O-* ! K(OH) 5.200e-13 ! kOH for T=298 only. ! kOH from: Atkinson (1989) OHRR 0.774 ! RO2-R. OHNR 0.008 ! RO2-N. OHR2 1.432 ! R2O2. OHQ1 0.218 ! CCO-O2. OHCO 0.478 ! CO OHC2 0.034 ! CO2 OHA1 0.229 ! HCHO OHA2 0.025 ! CCHO OHA3 0.006 ! RCHO OHZ1 0.362 ! HCOOH OHZ2 0.334 ! CCO-OH OHXX 0.256 ! INERT OHXC 0.422 ! C bal. calc. ! OH reaction generated Fri Mar 16 14:21:40 2001 PST ! 12BUOX : *CH(CH2-CH3)-CH2-O-* ! K(OH) 1.910e-12 ! kOH for T=298 only. ! kOH from: Wallington et al (1988c). OHRR 0.803 ! RO2-R. OHNR 0.059 ! RO2-N. OHR2 1.737 ! R2O2. OHQ2 0.138 ! RCO-O2. OHCO 0.508 ! CO OHC2 0.042 ! CO2 OHA1 0.023 ! HCHO OHA2 0.554 ! CCHO OHA3 0.019 ! RCHO OHK4 0.008 ! MEK OHBA 0.000 ! BACL OHZ1 0.502 ! HCOOH OHZ3 0.144 ! RCO-OH OHXX 0.245 ! INERT OHXC 0.284 ! C bal. calc. ! OH reaction generated Fri Mar 16 14:21:44 2001 PST ! FORMACID : HCO-OH ! K(OH) 4.500e-13 0.000 0.00 ! kOH from: Atkinson (1989) OHRH 1.000 ! HO2. OHC2 1.000 ! CO2 ! OH reaction generated Fri Mar 16 14:21:45 2001 PST ! ACETACID : CH3-CO-OH ! K(OH) 8.000e-13 ! kOH for T=298 only. ! kOH from: Atkinson (1994) OHRR 0.491 ! RO2-R. OHME 0.509 ! C-O2. OHC2 0.509 ! CO2 OHMG 0.491 ! MGLY OHXC -0.491 ! C bal. calc. ! OH reaction generated Fri Mar 16 14:21:46 2001 PST ! PROPACID : CH3-CH2-CO-OH ! K(OH) 1.160e-12 ! kOH for T=298 only. ! kOH from: Atkinson (1994) OHRH 0.000 ! HO2. OHRR 1.000 ! RO2-R. OHC2 0.142 ! CO2 OHA2 0.142 ! CCHO OHA3 0.400 ! RCHO OHBA 0.457 ! BACL OHXC -0.457 ! C bal. calc. ! OH reaction generated Fri Mar 16 14:21:49 2001 PST ! EGHE : CH3-CH2-CH2-CH2-CH2-CH2-O-CH2-CH2-OH ! K(OH) 2.892e-11 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.788 ! RO2-R. OHNR 0.212 ! RO2-N. OHR2 0.566 ! R2O2. OHA1 0.282 ! HCHO OHA2 0.001 ! CCHO OHA3 0.389 ! RCHO OHK6 0.680 ! PROD2 OHXC 1.195 ! C bal. calc. ! OH reaction generated Fri Mar 16 14:27:15 2001 PST ! EGEHE : CH3-CH2-CH2-CH2-CH(CH2-CH3)-CH2-O-CH2-CH2-OH ! K(OH) 3.243e-11 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.669 ! RO2-R. OHNR 0.331 ! RO2-N. OHR2 0.622 ! R2O2. OHA1 0.259 ! HCHO OHA2 0.046 ! CCHO OHA3 0.181 ! RCHO OHK6 0.792 ! PROD2 OHXC 2.367 ! C bal. calc. ! OH reaction generated Fri Mar 16 14:27:47 2001 PST ! DGEEA : CH3-CH2-O-CH2-CH2-O-CH2-CH2-O-CO-CH3 ! K(OH) 3.858e-11 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.696 ! RO2-R. OHNR 0.211 ! RO2-N. OHR2 0.946 ! R2O2. OHME 0.079 ! C-O2. OHQ2 0.014 ! RCO-O2. OHCO 0.138 ! CO OHA1 0.021 ! HCHO OHA2 0.026 ! CCHO OHA3 0.009 ! RCHO OHK4 0.845 ! MEK OHK6 0.404 ! PROD2 OHZ1 0.002 ! HCOOH OHZ2 0.152 ! CCO-OH OHXX 0.076 ! INERT OHXC 0.190 ! C bal. calc. ! OH reaction generated Fri Mar 16 14:28:05 2001 PST ! DGBEA : CH3-CH2-CH2-CH2-O-CH2-CH2-O-CH2-CH2-O-CO-CH3 ! K(OH) 4.293e-11 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.709 ! RO2-R. OHNR 0.279 ! RO2-N. OHR2 0.862 ! R2O2. OHQ2 0.012 ! RCO-O2. OHCO 0.108 ! CO OHA1 0.014 ! HCHO OHA2 0.009 ! CCHO OHA3 0.184 ! RCHO OHK4 0.648 ! MEK OHK6 0.441 ! PROD2 OHZ1 0.000 ! HCOOH OHZ2 0.120 ! CCO-OH OHXX 0.060 ! INERT OHXC 2.059 ! C bal. calc. ! OH reaction generated Fri Mar 16 14:28:33 2001 PST ! DGPE : CH3-CH2-CH2-O-CH2-CH2-O-CH2-CH2-OH ! K(OH) 4.381e-11 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.866 ! RO2-R. OHNR 0.134 ! RO2-N. OHR2 0.535 ! R2O2. OHA1 0.214 ! HCHO OHA2 0.192 ! CCHO OHA3 0.177 ! RCHO OHK4 0.351 ! MEK OHK6 0.732 ! PROD2 OHZ1 0.000 ! HCOOH OHXC -0.725 ! C bal. calc. ! OH reaction generated Fri Mar 16 14:28:43 2001 PST ! DGHE : CH3-CH2-CH2-CH2-CH2-CH2-O-CH2-CH2-O-CH2-CH2-OH ! K(OH) 4.807e-11 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.724 ! RO2-R. OHNR 0.276 ! RO2-N. OHR2 0.650 ! R2O2. OHA1 0.172 ! HCHO OHA2 0.002 ! CCHO OHA3 0.285 ! RCHO OHK6 0.902 ! PROD2 OHXC 1.902 ! C bal. calc. ! OH reaction generated Fri Mar 16 14:29:05 2001 PST ! TGME : CH3-O-CH2-CH2-O-CH2-CH2-O-CH2-CH2-OH ! K(OH) 5.321e-11 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.846 ! RO2-R. OHNR 0.154 ! RO2-N. OHR2 0.967 ! R2O2. OHA1 0.196 ! HCHO OHA2 0.001 ! CCHO OHA3 0.136 ! RCHO OHK4 0.191 ! MEK OHK6 0.922 ! PROD2 OHZ1 0.009 ! HCOOH OHXX 0.403 ! INERT OHXC -1.232 ! C bal. calc. ! OH reaction generated Fri Mar 16 14:29:19 2001 PST ! TGEE : CH3-CH2-O-CH2-CH2-O-CH2-CH2-O-CH2-CH2-OH ! K(OH) 6.003e-11 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.750 ! RO2-R. OHNR 0.199 ! RO2-N. OHR2 0.940 ! R2O2. OHME 0.052 ! C-O2. OHA1 0.164 ! HCHO OHA2 0.018 ! CCHO OHA3 0.121 ! RCHO OHK4 0.486 ! MEK OHK6 0.905 ! PROD2 OHZ1 0.009 ! HCOOH OHZ2 0.000 ! CCO-OH OHXC -1.189 ! C bal. calc. ! OH reaction generated Fri Mar 16 14:29:33 2001 PST ! TGBE : CH3-CH2-CH2-CH2-O-CH2-CH2-O-CH2-CH2-O-CH2-CH2-OH ! K(OH) 6.438e-11 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.729 ! RO2-R. OHNR 0.271 ! RO2-N. OHR2 0.861 ! R2O2. OHA1 0.139 ! HCHO OHA2 0.006 ! CCHO OHA3 0.225 ! RCHO OHK4 0.394 ! MEK OHK6 0.830 ! PROD2 OHZ1 0.006 ! HCOOH OHXC 0.992 ! C bal. calc. ! OH reaction generated Fri Mar 16 14:30:00 2001 PST ! TGPE : CH3-CH2-CH2-O-CH2-CH2-O-CH2-CH2-O-CH2-CH2-OH ! K(OH) 6.296e-11 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.766 ! RO2-R. OHNR 0.234 ! RO2-N. OHR2 0.885 ! R2O2. OHA1 0.147 ! HCHO OHA2 0.124 ! CCHO OHA3 0.114 ! RCHO OHK4 0.428 ! MEK OHK6 0.854 ! PROD2 OHZ1 0.007 ! HCOOH OHXC 0.015 ! C bal. calc. ! OH reaction generated Fri Mar 16 14:30:20 2001 PST ! TETRAGBE : CH3-CH2-CH2-CH2-O-CH2-CH2-O-CH2-CH2-O-CH2-CH2-O-CH2-CH2-OH ! K(OH) 8.353e-11 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.669 ! RO2-R. OHNR 0.331 ! RO2-N. OHR2 0.989 ! R2O2. OHA1 0.109 ! HCHO OHA2 0.005 ! CCHO OHA3 0.169 ! RCHO OHK4 0.369 ! MEK OHK6 0.913 ! PROD2 OHZ1 0.008 ! HCOOH OHXC 2.423 ! C bal. calc. ! OH reaction generated Fri Mar 16 14:31:03 2001 PST ! TETRAGME : CH3-O-CH2-CH2-O-CH2-CH2-O-CH2-CH2-O-CH2-CH2-OH ! K(OH) 7.236e-11 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.746 ! RO2-R. OHNR 0.254 ! RO2-N. OHR2 1.100 ! R2O2. OHA1 0.140 ! HCHO OHA2 0.001 ! CCHO OHA3 0.097 ! RCHO OHK4 0.234 ! MEK OHK6 1.003 ! PROD2 OHZ1 0.011 ! HCOOH OHXX 0.273 ! INERT OHXC -0.194 ! C bal. calc. ! OH reaction generated Fri Mar 16 14:31:28 2001 PST ! 2357TMC8 : CH3-CH(CH3)-CH(CH3)-CH2-CH(CH3)-CH2-CH(CH3)-CH3 ! K(OH) 1.449e-11 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.484 ! RO2-R. OHNR 0.516 ! RO2-N. OHR2 1.340 ! R2O2. OHA1 0.033 ! HCHO OHA2 0.076 ! CCHO OHA3 0.289 ! RCHO OHK3 0.379 ! ACET OHK4 0.005 ! MEK OHK6 0.358 ! PROD2 OHXC 4.544 ! C bal. calc. ! OH reaction generated Fri Mar 16 14:37:14 2001 PST ! 2468TMC9 : CH3-CH(CH3)-CH2-CH(CH3)-CH2-CH(CH3)-CH2-CH(CH3)-CH3 ! K(OH) 1.591e-11 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.457 ! RO2-R. OHNR 0.543 ! RO2-N. OHR2 1.240 ! R2O2. OHA1 0.015 ! HCHO OHA2 0.002 ! CCHO OHA3 0.361 ! RCHO OHK3 0.075 ! ACET OHK4 0.001 ! MEK OHK6 0.348 ! PROD2 OHXC 6.322 ! C bal. calc. ! OH reaction generated Fri Mar 16 14:39:44 2001 PST ! 236M4IC7 : CH3-CH(CH3)-CH(CH3)-CH(CH(CH3)-CH3)-CH2-CH(CH3)-CH3 ! K(OH) 1.630e-11 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.485 ! RO2-R. OHNR 0.515 ! RO2-N. OHR2 1.485 ! R2O2. OHA1 0.015 ! HCHO OHA2 0.269 ! CCHO OHA3 0.306 ! RCHO OHK3 0.593 ! ACET OHK4 0.165 ! MEK OHK6 0.282 ! PROD2 OHXC 4.304 ! C bal. calc. ! OH reaction generated Fri Mar 16 14:46:13 2001 PST ! 24568MC9 : CH3-CH(CH3)-CH2-CH(CH3)-CH(CH3)-CH(CH3)-CH2-CH(CH3)-CH3 ! K(OH) 1.759e-11 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.431 ! RO2-R. OHNR 0.569 ! RO2-N. OHR2 1.496 ! R2O2. OHA1 0.022 ! HCHO OHA2 0.094 ! CCHO OHA3 0.089 ! RCHO OHK3 0.064 ! ACET OHK4 0.020 ! MEK OHK6 0.847 ! PROD2 OHXC 4.755 ! C bal. calc. ! OH reaction generated Fri Mar 16 14:50:18 2001 PST ! 2M35IPC7 : CH3-CH(CH3)-CH(CH(CH3)-CH3)-CH2-CH(CH(CH3)-CH3)-CH2-CH3 ! K(OH) 1.812e-11 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.459 ! RO2-R. OHNR 0.541 ! RO2-N. OHR2 1.318 ! R2O2. OHA1 0.005 ! HCHO OHA2 0.060 ! CCHO OHA3 0.162 ! RCHO OHK3 0.646 ! ACET OHK4 0.001 ! MEK OHK6 0.367 ! PROD2 OHXC 5.996 ! C bal. calc. ! OH reaction generated Fri Mar 16 14:53:36 2001 PST ! 268M4IC9 : CH3-CH(CH3)-CH2-CH(CH(CH3)-CH3)-CH2-CH(CH3)-CH2-CH(CH3)-CH3 ! K(OH) 1.914e-11 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.436 ! RO2-R. OHNR 0.564 ! RO2-N. OHR2 1.276 ! R2O2. OHA1 0.009 ! HCHO OHA2 0.001 ! CCHO OHA3 0.284 ! RCHO OHK3 0.265 ! ACET OHK4 0.001 ! MEK OHK6 0.346 ! PROD2 OHXC 7.876 ! C bal. calc. ! OH reaction generated Fri Mar 16 15:02:22 2001 PST ! 27M35IC8 : CH3-CH(CH3)-CH(CH(CH3)-CH3)-CH2-CH(CH(CH3)-CH3)-CH2-CH(CH3)-CH3 ! K(OH) 2.094e-11 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.430 ! RO2-R. OHNR 0.570 ! RO2-N. OHR2 1.350 ! R2O2. OHA1 0.005 ! HCHO OHA2 0.003 ! CCHO OHA3 0.234 ! RCHO OHK3 0.562 ! ACET OHK4 0.001 ! MEK OHK6 0.329 ! PROD2 OHXC 8.205 ! C bal. calc. ! OH reaction generated Fri Mar 16 15:42:17 2001 PST ! 2346TMC7 : CH3-CH(CH3)-CH(CH3)-CH(CH3)-CH2-CH(CH3)-CH3 ! K(OH) 1.307e-11 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.534 ! RO2-R. OHNR 0.466 ! RO2-N. OHR2 1.429 ! R2O2. OHA1 0.036 ! HCHO OHA2 0.256 ! CCHO OHA3 0.076 ! RCHO OHK3 0.446 ! ACET OHK4 0.150 ! MEK OHK6 0.492 ! PROD2 OHXC 2.534 ! C bal. calc. ! OH reaction generated Fri Mar 16 15:45:38 2001 PST ! 2ETHXACD : CH3-CH2-CH(CO-OH)-CH2-CH2-CH2-CH3 ! K(OH) 1.330e-11 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.712 ! RO2-R. OHNR 0.288 ! RO2-N. OHR2 0.979 ! R2O2. OHC2 0.033 ! CO2 OHA2 0.154 ! CCHO OHA3 0.318 ! RCHO OHK6 0.330 ! PROD2 OHBA 0.331 ! BACL OHXC 1.679 ! C bal. calc. ! OH reaction generated Fri Mar 16 15:46:18 2001 PST ! DBE-10 : CH3-O-CO-CH2-CH2-CH2-CH2-CH2-CH2-CH2-CH2-CO-O-CH3 ! K(OH) 9.687e-12 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.559 ! RO2-R. OHNR 0.441 ! RO2-N. OHR2 0.729 ! R2O2. OHCO 0.022 ! CO OHK6 0.533 ! PROD2 OHBA 0.026 ! BACL OHXC 6.030 ! C bal. calc. ! OH reaction generated Fri Mar 16 15:46:33 2001 PST ! DPGOME2 : CH3-O-CH(CH3)-CH2-O-CH(CH3)-CH2-OH ! K(OH) 5.476e-11 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.733 ! RO2-R. OHNR 0.139 ! RO2-N. OHR2 0.546 ! R2O2. OHME 0.128 ! C-O2. OHA1 0.346 ! HCHO OHA2 0.028 ! CCHO OHA3 0.187 ! RCHO OHK4 0.008 ! MEK OHK6 0.669 ! PROD2 OHZ1 0.002 ! HCOOH OHXX 0.446 ! INERT OHXC 0.575 ! C bal. calc. ! OH reaction generated Fri Mar 16 15:46:39 2001 PST ! GLYACD : HO-CH2-CO-OH ! K(OH) 3.080e-12 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRH 1.000 ! HO2. OHC2 0.035 ! CO2 OHA1 0.035 ! HCHO OHMG 0.965 ! MGLY OHXC -0.965 ! C bal. calc. ! OH reaction generated Fri Mar 16 15:46:54 2001 PST ! 22MEOC3 : CH3-O-C(CH3)(CH3)-O-CH3 ! K(OH) 2.645e-12 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRR 0.914 ! RO2-R. OHNR 0.070 ! RO2-N. OHR2 0.137 ! R2O2. OHME 0.016 ! C-O2. OHA1 0.257 ! HCHO OHK3 0.002 ! ACET OHK4 0.796 ! MEK OHXX 0.132 ! INERT OHXC 0.985 ! C bal. calc. ! OH reaction generated Fri Mar 16 15:46:57 2001 PST ! TMPDG : CH3-CH(CH3)-CH(OH)-C(CH3)(CH3)-CH2-OH ! K(OH) 1.760e-11 ! kOH for T=300 only. ! kOH from: Estimated for T=300K. OHRH 0.792 ! HO2. OHRR 0.173 ! RO2-R. OHNR 0.035 ! RO2-N. OHA1 0.026 ! HCHO OHA2 0.003 ! CCHO OHA3 0.375 ! RCHO OHK3 0.086 ! ACET OHK4 0.011 ! MEK OHK6 0.589 ! PROD2 OHXC 2.793 ! C bal. calc. ! OH reaction generated Fri Mar 16 15:47:04 2001 PST ! DGEE : CH3-CH2-O-CH2-CH2-O-CH2-CH2-OH ! K(OH) 5.720e-11 ! kOH for T=298 only. ! kOH from: Atkinson et al (2000c). Report to ACC Glycol Ethers Panel, In prep ! aration (November). OHRR 0.719 ! RO2-R. OHNR 0.125 ! RO2-N. OHR2 0.456 ! R2O2. OHME 0.156 ! C-O2. OHA1 0.282 ! HCHO OHA2 0.010 ! CCHO OHA3 0.150 ! RCHO OHK4 0.371 ! MEK OHK6 0.719 ! PROD2 OHXC -1.459 ! C bal. calc. ! OH reaction generated Fri Mar 23 15:41:41 2001 PST ! DGBE : CH3-CH2-CH2-CH2-O-CH2-CH2-O-CH2-CH2-OH ! K(OH) 7.440e-11 ! kOH for T=298 only. ! kOH from: Atkinson et al (2000c). Report to ACC Glycol Ethers Panel, In prep ! aration (November, 2000). OHRR 0.820 ! RO2-R. OHNR 0.180 ! RO2-N. OHR2 0.530 ! R2O2. OHA1 0.198 ! HCHO OHA2 0.010 ! CCHO OHA3 0.345 ! RCHO OHK4 0.317 ! MEK OHK6 0.708 ! PROD2 OHZ1 0.000 ! HCOOH OHXC 0.149 ! C bal. calc. ! OH reaction generated Fri Mar 23 15:43:33 2001 PST