Gas (G) and particle (P) species from the namelists. SMILES link to representative structures in the EPA Chemicals Dashboard (if available).
Note that for each particulate species in CMAQ, a letter will be appended to the name to designate the size, or mode, of the aerosol being represented: I = Aitken mode, J = Accumulation mode, K = Coarse mode. Prepending of a species with a V or A in CMAQ or the chemical mechanism files indicates the species resides in the gas or particulate phase.
Species |
Description |
Phase |
Molecular Weight (g/mol) |
Explicit/ Lumped |
Representative Structure |
SMILES |
---|---|---|---|---|---|---|
AAL |
Aluminum ion |
P |
27.0 |
E |
Aluminum ion |
|
ACA |
Calcium ion |
P |
40.1 |
E |
Calcium ion |
|
ACD |
Acetaldehyde |
G |
44.0 |
E |
Acetaldehyde |
|
ACE |
Acetylene |
G |
26.0 |
E |
Acetylene |
|
ACL |
Chloride ion |
P |
35.5 |
E |
Chloride ion |
|
ACO3 |
Acetyl peroxy radicals |
G |
75.0 |
E |
Acetylperoxy |
|
ACORS |
Primary unspeciated coarse PM |
P |
100.0 |
L |
Coarse PM |
|
ACRO |
Acrolein |
G |
56.1 |
E |
Acrolein |
|
ACT |
Acetone |
G |
58.0 |
E |
Acetone |
|
ACTP |
Peroxy radicals formed from ACT |
G |
89.0 |
E |
(2-oxopropyl)peroxy |
CC(=O)CO[O] |
ADCN |
Aromatic-NO3 adduct from PHEN |
G |
155.0 |
L |
4-oxocyclohex-2-en-1-yl nitrate |
OC1=C[C]C(O[N+]([O-])=O)C=C1 |
ADDC |
Aromatic-HO adduct from CSL |
G |
125.0 |
L |
3-methyl-5-oxocyclohex-3-en-1-yloxidanyl |
CC1=CC(O)=CC([O])C1 |
AEC |
Elemental carbon |
P |
12.0 |
L |
Carbon |
[C] |
AFE |
Iron ion |
P |
55.8 |
E |
Iron ion |
|
AGLY |
SOA from reactive uptake of glyoxal on particles |
P |
66.4 |
L |
2-(4,5-dihydroxy-1,3-dioxolan-2-yl)-1,3-dioxolane-4,5-diol |
OC2OC(C1OC(O)C(O)O1)OC2O |
AH2O |
Water associated with particulate inorganic compounds |
P |
18.0 |
E |
Water |
|
AH3OP |
Hydronium ion tracer |
P |
19.0 |
E |
Hydronium ion |
|
AISO3NOS |
Non-sulfated SOA from IEPOX uptake |
P |
136.2 |
L |
2-methylbutane-1,2,3,4-tetrol |
C(O)C(O)(C)C(O)CO |
AISO3OS |
Organosulfate SOA from IEPOX uptake |
P |
216.2 |
L |
(1,3,4-trihydroxy-2-methylbutan-2-yl)oxysulfonic acid |
C(O)C(OS(O)(=O)(=O))(C)C(O)CO |
AK |
Potassium ion |
P |
39.1 |
E |
Potassium ion |
|
ALD |
C3 and higher aldehydes |
G |
58.0 |
L |
Propanal |
|
AMG |
Magnesium ion |
P |
24.3 |
E |
Magnesium ion |
[Mg++] |
AMN |
Manganese ion |
P |
54.9 |
L |
Manganese ions |
|
ANA |
Sodium ion |
P |
23.0 |
E |
Sodium ion |
|
ANH4 |
Ammonium ion |
P |
18.0 |
E |
Ammonium ion |
|
ANO3 |
Nitrate ion |
P |
62.0 |
E |
Nitrate ion |
|
AORGC |
SOA from cloud processing of GLY and MGLY |
P |
177.0 |
L |
2-(4,5-dihydroxy-1,3-dioxolan-2-yl)-1,3-dioxolane-4,5-diol |
OC2OC(C1OC(O)C(O)O1)OC2O |
AORGH2O |
Water associated with particulate organic compounds |
P |
18.0 |
E |
Water |
|
AOTHR |
Primary unspeciated fine PM |
P |
200.0 |
L |
Unspeciated PM |
|
API |
Alpha-pinenes and other cyclic terpenes with one double bond |
G |
136.4 |
L |
alpha-pinene |
|
APINP1 |
Peroxy radicals from API+NO3 that do not undergo autoxidation |
G |
230.0 |
L |
[2,6,6-trimethyl-3-(nitrooxy)bicyclo[3.1.1]heptan-2-yl]peroxy |
[O]OC1(C)C(ON(=O)=O)CC2CC1C2(C)C |
APINP2 |
Peroxy radicals from API+NO3 that undergo autoxidation |
G |
230.0 |
L |
[2,6,6-trimethyl-3-(nitrooxy)bicyclo[3.1.1]heptan-2-yl]peroxy |
[O]OC1(C)C(ON(=O)=O)CC2CC1C2(C)C |
APIP1 |
Peroxy radicals from API+OH that do not undergo autoxidation |
G |
185.0 |
L |
{3-hydroxy-2,6,6-trimethylbicyclo[3.1.1]heptan-2-yl}peroxy |
[O]OC1(C)C(O)CC2CC1C2(C)C |
APIP2 |
Peroxy radicals from API+OH that undergo autoxidation |
G |
185.0 |
L |
{3-hydroxy-2,6,6-trimethylbicyclo[3.1.1]heptan-2-yl}peroxy |
[O]OC1(C)C(O)CC2CC1C2(C)C |
APNCOM |
Primary non-carbon organic matter (legacy) |
P |
220.0 |
L |
Non-carbon organic matter |
|
APOC |
Primary organic carbon (legacy) |
P |
220.0 |
L |
Organic carbon |
|
ASEACAT |
Sea spray cations |
P |
23.75 |
L |
Coarse sea spray cations |
|
ASI |
Silicon |
P |
28.1 |
E |
Total Silicon |
|
ASO4 |
Total sulfur IV as sulfate |
P |
96.0 |
L |
Sulfate ion |
|
ASOAT |
An empirical SOA |
P |
200.0 |
L |
3,4,5,6,7-Pentahydroxyheptan-2-one |
|
ASOIL |
Lumped crustal species |
P |
100.0 |
L |
Crustal species |
|
ATI |
Titanium |
P |
47.9 |
E |
Total Titanium |
|
BAL1 |
Peroxy radicals formed from BALD |
G |
123.0 |
L |
(4-methylphenyl)peroxy |
[O]OC1=CC=C(C)C=C1 |
BAL2 |
Peroxy radicals formed from BALD |
G |
109.0 |
L |
phenylperoxy |
[O]OC1=CC=CC=C1 |
BALD |
Benzaldehyde and other aromatic aldehydes |
G |
106.0 |
L |
Benzaldehyde |
|
BALP |
Peroxy radicals formed from BALD |
G |
137.0 |
L |
benzoylperoxy |
O=C(O[O])C1=CC=CC=C1 |
BDE13 |
1,3-butadiene |
G |
54.1 |
E |
1,3-Butadiene |
|
BDE13P |
Peroxy radicals from BDE13 |
G |
103.0 |
L |
(1-hydroxybut-3-en-2-yl)peroxy |
C=CC(O[O])CO |
BEN |
Benzene |
G |
78.11 |
E |
Benzene |
|
BENP |
Peroxy radicals formed from benzene |
G |
159.12 |
L |
{8-hydroxy-6,7-dioxabicyclo[3.2.1]oct-3-en-2-yl}peroxy |
[O]OC1C=CC2OOC1C2O |
CHO |
Phenoxy radical formed from CSL |
G |
139.0 |
L |
4-hydroxy-3,5-dimethylcyclohexa-2,5-dien-1-yloxidanyl |
[O]C1C=C(C)C(O)C(=C1)C |
CO |
Carbon monoxide |
G |
28.0 |
E |
Carbon monoxide |
|
CSL |
Cresol and other hydroxy substituted aromatics |
G |
136.2 |
L |
2-Phenylpropan-2-ol |
|
DCB1 |
Unsaturated dicarbonyls |
G |
98.0 |
L |
2-methylbut-2-enedial |
O=CC=C(C)C=O |
DCB2 |
Unsaturated dicarbonyls |
G |
112.1 |
L |
2-methyl-4-oxopent-2-enal |
O=CC(=CC(=O)C)C |
DCB3 |
Unsaturated dicarbonyls |
G |
84.0 |
L |
but-2-enedial |
O=CC=CC=O |
ELHOM |
Extremely-low volatility highly oxygenated molecules from terpenes |
GP |
402.0 |
L |
6-hydroperoxy-7-({3-hydroxy-2,6,6-trimethylbicyclo[3.1.1]heptan-2-yl}peroxy)-3,3,6-trimethyl-tetrahydro-3aH-1,2-benzodioxol-5-ol |
OC1CC2C(OOC2(C)C)C(OOC3(C)C4C(C)(C)C(C4)CC3O)C1(C)OO |
EOH |
Ethanol |
G |
46.1 |
E |
Ethanol |
|
ETE |
ethene |
G |
28.1 |
E |
Ethylene |
|
ETEG |
Ethylene glycol |
G |
62.1 |
E |
Ethylene glycol |
|
ETEP |
Peroxy radicals formed from ETE |
G |
77.0 |
E |
(2-hydroxyethyl)peroxy |
OCCO[O] |
ETH |
ethane |
G |
30.1 |
E |
Ethane |
|
ETHP |
Peroxy radicals formed from ethane and other species |
G |
61.0 |
L |
Ethylperoxy |
|
FURAN |
Furans and other dienes |
G |
96.1 |
L |
Furfural |
|
FURANO2 |
Peroxy radicals from FURAN oxidation |
G |
145.1 |
L |
(2-formyl-5-hydroxy-5H-furan-2-yl)peroxy |
OC1C=CC(O1)(O[O])(C=O) |
FURANONE |
Ring-retaining ketone product from FURAN oxidation |
G |
100.1 |
L |
2-hydroxy-2H-furan-5-one |
|
GLY |
Glyoxal and glycoaldehydes |
G |
58.0 |
L |
Glyoxal |
|
H2O2 |
Hydrogen peroxide |
G |
34.0 |
E |
Hydrogen peroxide |
|
HC10 |
Alkanes and other species with HO rate constant greater than 6.8x10-12 cm3 s-1 |
G |
142.28 |
L |
Decane |
|
HC10P |
Peroxy radicals formed from HC10 |
G |
173.27 |
L |
Decan-3-ylperoxy |
CCCCCCCC(CC)O[O] |
HC10P2 |
Hydroxy peroxy radicals from HC10P alkoxy product |
G |
189.27 |
L |
(8-hydroxydecan-5-yl)peroxy |
CCCCC(O[O])CCC(O)CC |
HC3 |
Alkanes and other species with HO rate constant less than 3.4x10-12 cm3 s-1 |
G |
44.1 |
L |
Propane |
|
HC3P |
Peroxy radicals formed from HC3 |
G |
75.0 |
L |
Isopropyl peroxy |
CC(C)O[O] |
HC5 |
Alkanes and other species with HO rate constant between 3.4x10-12 and 6.8x10-12 cm3 s-1 |
G |
72.1 |
L |
Pentane |
|
HC5P |
Peroxy radicals formed from HC5 |
G |
103.0 |
L |
Pentan-3-ylperoxy |
CCC(O[O])CC |
HCHO |
Formaldehyde |
G |
30.0 |
E |
Formaldehyde |
|
HCL |
Hydrochloric acid |
G |
36.0 |
E |
Hydrochloric acid |
|
HKET |
Hydroxy ketone |
G |
74.0 |
L |
Hydroxy acetone |
|
HNO3 |
Nitric acid |
G |
63.0 |
E |
Nitric acid |
|
HNO4 |
Pernitric acid |
G |
79.0 |
E |
Hydroxy nitrate |
|
HO |
Hydroxy radical |
G |
17.0 |
E |
Hydroxyl radical |
[OH] |
HO2 |
Hydroperoxy radical |
G |
33.0 |
E |
Hydroperoxy |
|
HOM |
Highly oxygenated molecules from terpenes |
GP |
250.0 |
L |
6,7-dihydroperoxy-3,3,6-trimethyl-tetrahydro-3aH-1,2-benzodioxol-5-ol |
OC1CC2C(OOC2(C)C)C(OO)C1(C)OO |
HONO |
Nitrous acid |
G |
47.0 |
E |
Nitrous acid |
|
IEPOX |
isoprene epoxydiols |
G |
118.1 |
E |
Isoprene epoxydiol |
OCC1OC1(C)CO |
IEPOXP |
IEPOX intermediate (tracking species) |
G |
118.1 |
NA |
||
ISHP |
Beta-hydroxy hydroperoxides from ISOP+HO2 |
G |
118.0 |
L |
2-hydroperoxy-2-methylbut-3-en-1-ol |
C=CC(OO)(CO)C |
ISO |
Isoprene |
G |
68.1 |
E |
Isoprene |
|
ISON |
Beta-hydroxyalkylnitrates from ISOP+NO alkylnitrates from ISO+NO3 |
G |
147.0 |
L |
2-methyl-2-(nitrooxy)but-3-en-1-ol |
OCC(C)(C=C)ON(=O)=O |
ISOP |
Peroxy radicals formed from ISO+HO |
G |
117.0 |
L |
(1-hydroxy-3-methylbut-3-en-2-yl)peroxy |
OCC(O[O])C(C)=C |
KET |
ketones |
G |
86.0 |
L |
Diethylketone |
|
KETP |
Peroxy radicals formed from KET |
G |
117.0 |
L |
(3-oxopentan-2-yl)peroxy |
CCC(C(C)O[O])=O |
LIM |
d-limonene and other cyclic diene-terpenes |
G |
136.3 |
L |
D-Limonene |
|
LIMAL |
Limonene aldehyde and similar LIM-derived aldehydes |
G |
168.0 |
L |
Limonaldehyde |
O=CCC(CCC(=O)C)C(=C)C |
LIMALP |
Peroxy radicals from LIMAL |
G |
217.0 |
L |
[1-hydroxy-2-methyl-5-oxo-3-(3-oxobutyl)pentan-2-yl]peroxy |
O=CCC(CCC(=O)C)C(C)(CO)O[O] |
LIMNP1 |
Peroxy radicals from LIM+NO3 that do not undergo autoxidation |
G |
230.0 |
L |
[1-methyl-2-(nitrooxy)-4-(prop-1-en-2-yl)cyclohexyl]peroxy |
[O-][N+](=O)OC1CC(CCC1(C)O[O])C(=C)C |
LIMNP2 |
Peroxy radicals from LIM+NO3 that undergo autoxidation |
G |
230.0 |
L |
[1-methyl-2-(nitrooxy)-4-(prop-1-en-2-yl)cyclohexyl]peroxy |
[O-][N+](=O)OC1CC(CCC1(C)O[O])C(=C)C |
LIMP1 |
Peroxy radicals from LIM+OH that do not undergo autoxidation |
G |
185.0 |
L |
[2-hydroxy-1-methyl-4-(prop-1-en-2-yl)cyclohexyl]peroxy |
[O]OC1(C)CCC(CC1O)C(=C)C |
LIMP2 |
Peroxy radicals from LIM+OH that undergo autoxidation |
G |
185.0 |
L |
[2-hydroxy-1-methyl-4-(prop-1-en-2-yl)cyclohexyl]peroxy |
[O]OC1(C)CCC(CC1O)C(=C)C |
MACP |
Peroxy radicals formed from MACR+HO |
G |
101.0 |
L |
(2-methylprop-2-enoyl)peroxy |
CC(=C)C(=O)O[O] |
MACR |
methacrolein and other C4 aldehydes |
G |
70.0 |
L |
Methacrolein |
|
MAHP |
Hydroperoxides from MACP+HO2 |
G |
102.0 |
L |
2-methylprop-2-eneperoxoic acid |
C=C(C)C(OO)=O |
MCP |
Peroxy radical formed from MACR + HO which does not form MPAN |
G |
119.0 |
L |
(1-hydroxy-2-methyl-3-oxopropan-2-yl)peroxy |
OCC(C)(O[O])C=O |
MCT |
Methyl catechol |
G |
124.1 |
L |
4-Methylcatechol |
|
MCTO |
Alkoxy radical formed from MCT+HO and MCT+NO3 |
G |
123.0 |
L |
3-hydroxy-5-methylphenyloxidanyl |
CC1=CC(O)=CC([O])=C1 |
MCTP |
Radical formed fro MCT+O3 reaction |
G |
172.0 |
L |
C7H8O5 Biradical |
CC(/C=C\[C](O[O])O)=C/C(O)=O |
MEK |
Methyl ethyl ketone |
G |
72.1 |
E |
Methyl ethyl ketone |
|
MEKP |
Peroxy radicals formed from MEK |
G |
103.0 |
L |
(3-oxobutyl)peroxy |
[O]OCCC(=O)C |
MGLY |
Methylglyoxal and other alpha-carbonyl aldehydes |
G |
72.0 |
L |
Methyl glyoxal |
|
MO2 |
Methyl peroxy radical |
G |
47.0 |
E |
Methylperoxy |
|
MOH |
Methanol |
G |
32.0 |
E |
Methanol |
|
MPAN |
Peroxymethacryloylnitrate and other higher peroxyacylnitrates from isoprene oxidation |
G |
147.1 |
L |
Peroxymethacryloyl nitrate |
|
MVK |
Methyl vinyl ketone |
G |
70.1 |
E |
Methyl vinyl ketone |
|
MVKP |
Peroxy radicals formed from MVK |
G |
119.0 |
L |
(2-hydroxy-3-oxobutyl)peroxy |
CC(=O)C(O)CO[O] |
N2O5 |
Dinitrogen pentoxide |
G |
108.0 |
E |
Dinitrogen pentoxide |
|
NALD |
Nitrooxyacetaldehyde |
G |
105.0 |
E |
1-(nitrooxy)acetaldehyde |
O=CCON(=O)=O |
NAPH |
Naphthalene and other PAHs |
G |
128.17 |
L |
Naphthalene |
|
NAPHP |
Peroxy radicals from NAPH oxidation |
G |
209.17 |
L |
{8-hydroxy-10,11-dioxatricyclo[7.2.1.0^{2,7}]dodeca-2,4,6-trien-12-yl}peroxy |
C12=CC=CC=C1C3OOC(C3O[O])C2(O) |
NH3 |
Ammonia |
G |
17.0 |
E |
Ammonia |
|
NO |
Nitric oxide |
G |
30.0 |
E |
Nitric oxide |
|
NO2 |
Nitrogen dioxide |
G |
46.0 |
E |
Nitrogen dioxide |
|
NO3 |
Nitrogen trioxide |
G |
62.0 |
E |
Nitrate radical |
[O]N(=O)=O |
NUM |
Number of particles |
P |
1.0 |
L |
Number of particles |
|
O1D |
Excited state oxygen atom, O(1D) |
G |
16.0 |
E |
Excited oxygen |
|
O3 |
Ozone |
G |
48.0 |
E |
Ozone |
|
O3P |
Ground state oxygen atom, O(3P) |
G |
16.0 |
E |
Ground state oxygen |
|
OLI |
Internal alkenes |
G |
70.1 |
L |
2-Methyl-2-butene |
|
OLIP |
Peroxy radicals formed from OLI |
G |
119.0 |
L |
(3-hydroxy-2-methylbutan-2-yl)peroxy |
[O]OC(C)(C)C(C)O |
OLND |
NO3-alkene adduct reacting via decomposition |
G |
136.0 |
L |
[1-(nitrooxy)propan-2-yl]peroxy |
CC(O[O])CO[N+]([O-])=O |
OLNN |
NO3-alkene adduct reacting to form carbonitrates + HO2 |
G |
136.0 |
L |
[1-(nitrooxy)propan-2-yl]peroxy |
CC(O[O])CO[N+]([O-])=O |
OLT |
Terminal alkenes |
G |
42.0 |
L |
1-Propene |
|
OLTP |
Peroxy radicals formed from OLT |
G |
91.0 |
L |
(1-hydroxypropan-2-yl)peroxy |
CC(CO)O[O] |
ONIT |
Organic nitrates |
G |
119.0 |
L |
Butan-2-yl nitrate |
|
OP1 |
Methyl hydrogen peroxide |
G |
48.0 |
E |
Methyl hydroperoxide |
|
OP2 |
Higher organic peroxides |
G |
62.0 |
L |
Ethyl hydroperoxide |
|
OP3 |
Semivolatile organic peroxide |
GP |
176.2 |
L |
5-hydroperoxy-6-hydroxyoctan-3-one |
CCC(=O)CC(OO)C(O)CC |
OPB |
Terpene-derived peroxides |
G |
186.2 |
L |
2-hydroperoxy-2,6,6-trimethylbicyclo[3.1.1]heptan-3-ol |
OOC1(C)C(O)CC2CC1C2(C)C |
ORA1 |
Formic acid |
G |
46.0 |
E |
Formic acid |
|
ORA2 |
Acetic acid and higher acids |
G |
60.2 |
L |
Acetic acid |
|
ORAP |
Peroxy radical formed from ORA2 + HO reaction |
G |
91.0 |
L |
(carboxymethyl)peroxy |
[O]OCC(=O)O |
PAA |
Peroxyacetic acids and higher analogs |
G |
76.0 |
L |
Peroxyacetic acid |
|
PAN |
Peroxyacetyl nitrate and higher saturated PANs |
G |
121.0 |
L |
Peroxyacetyl nitrate |
|
PHEN |
phenol and benzene diols |
G |
110.1 |
L |
Resorcinol |
|
PINAL |
Pinonaldehyde and similar APIN-derived aldehydes |
G |
168.0 |
L |
Pinonaldehyde |
O=CCC1CC(C(=O)C)C1(C)C |
PINALP |
Peroxy radicals from PINAL oxidation |
G |
199.0 |
L |
[3-acetyl-2,2-dimethyl-1-(2-oxoethyl)cyclobutyl]peroxy |
O=CCC1(O[O])CC(C(=O)C)C1(C)C |
PPN |
Peroxypropionyl nitrate |
G |
135.0 |
E |
Peroxypopionyl nitrate |
|
PROG |
Propylene glyocol and other 3 carbon dialcohols |
G |
76.1 |
E |
1,2-Propylene glycol |
|
RCO3 |
Higher saturated acyl peroxy radicals |
G |
89.0 |
L |
Propanoylperoxy |
CCC(=O)O[O] |
ROCIOXY |
Intermediate volatility oxygenated ROC species (directly emitted) |
G |
247.0 |
L |
Decamethylcyclopentasiloxane |
|
ROCN1ALK |
Alkane-like ROC species with C* of 10-1 μg m-3 |
GP |
408.8 |
L |
5,9-Dimethylheptacosane |
|
ROCN1OXY1 |
Oxygenated ROC species with C* of 10-1 μg m-3 and O:C of 0.1 |
GP |
312.5 |
L |
Arachidic Acid |
|
ROCN1OXY3 |
Oxygenated ROC species with C* of 10-1 μg m-3 and O:C of 0.3 |
GP |
230.3 |
L |
DODECANEDIOIC ACID |
|
ROCN1OXY6 |
Oxygenated ROC species with C* of 10-1 μg m-3 and O:C of 0.6 |
GP |
190.2 |
L |
2-hydroxy-octanedioic acid |
C(CCC(C(=O)O)O)CCC(=O)O |
ROCN2ALK |
Alkane-like ROC species with C* of 10-2 μg m-3 |
GP |
422.83 |
L |
Triacontane |
|
ROCN2OXY2 |
Oxygenated ROC species with C* of 10-1 μg m-3 and O:C of 0.2 |
GP |
282.4 |
L |
12(S)-hydroxy-16-Heptadecynoic Acid |
C#CCCC[C@H](CCCCCCCCCCC(=O)O)O |
ROCN2OXY4 |
Oxygenated ROC species with C* of 10-2 μg m-3 and O:C of 0.4 |
GP |
232.3 |
L |
2-HYDROXYUNDECANEDIOIC ACID |
|
ROCN2OXY8 |
Oxygenated ROC species with C* of 10-2 μg m-3 and O:C of 0.8 |
GP |
194.2 |
L |
3,4,5,6,7-Pentahydroxyheptan-2-one |
|
ROCP0ALK |
Alkane-like ROC species with C* of 1 μg m-3 |
GP |
394.77 |
L |
11-Methylheptacosane |
|
ROCP0OXY2 |
Oxygenated ROC species with C* of 1 μg m-3 and O:C of 0.2 |
GP |
242.4 |
L |
3-oxotetradecanoic acid |
|
ROCP0OXY4 |
Oxygenated ROC species with C* of 1 μg m-3 and O:C of 0.4 |
GP |
202.3 |
L |
DECANEDIOIC ACID |
|
ROCP1ALK |
Alkane-like ROC species with C* of 10 μg m-3 |
GP |
380.75 |
L |
Heptacosane |
|
ROCP1ALKP |
Peroxy radicals from ROCP1ALK oxidation |
G |
411.74 |
L |
heptacosan-3-ylperoxy |
CCCCCCCCCCCCCCCCCCCCCCCCC(CC)O[O] |
ROCP1ALKP2 |
Hydroxy peroxy radicals from ROCP1ALK alkoxy product |
G |
427.73 |
L |
(3-hydroxyheptacosan-6-yl)peroxy |
CCCCCCCCCCCCCCCCCCCCCC(O[O])CCC(O)CC |
ROCP1OXY1 |
Oxygenated ROC species with C* of 10 μg m-3 and O:C of 0.1 |
GP |
270.5 |
L |
HEPTADECANOIC ACID |
|
ROCP1OXY3 |
Oxygenated ROC species with C* of 10 μg m-3 and O:C of 0.3 |
GP |
202.3 |
L |
11-hydroxyundecanoic acid |
|
ROCP2ALK |
Alkane-like ROC species with C* of 10+2 μg m-3 |
GP |
338.66 |
L |
Tetracosane |
|
ROCP2ALKP |
Peroxy radicals from ROCP2ALK oxidation |
G |
369.65 |
L |
tetracosan-3-ylperoxy |
CCCCCCCCCCCCCCCCCCCCCC(CC)O[O] |
ROCP2ALKP2 |
Hydroxy peroxy radicals from ROCP2ALK alkoxy product |
G |
385.65 |
L |
(3-hydroxytetracosan-6-yl)peroxy |
CCCCCCCCCCCCCCCCCCC(O[O])CCC(O)CC |
ROCP2OXY2 |
Oxygenated ROC species with C* of 10+2 μg m-3 and O:C of 0.2 |
GP |
200.3 |
L |
Dodecanoic Acid |
|
ROCP3ALK |
Alkane-like ROC species with C* of 10+3 μg m-3 |
GP |
296.58 |
L |
Heneicosane |
|
ROCP3ALKP |
Peroxy radicals from ROCP3ALK oxidation |
G |
327.57 |
L |
henicosan-3-ylperoxy |
CCCCCCCCCCCCCCCCCCC(CC)O[O] |
ROCP3ALKP2 |
Hydroxy peroxy radicals from ROCP3ALK alkoxy product |
G |
343.57 |
L |
(3-hydroxyhenicosan-6-yl)peroxy |
CCCCCCCCCCCCCCCC(O[O])CCC(O)CC |
ROCP3OXY2 |
Oxygenated ROC species with C* of 10+3 μg m-3 and O:C of 0.2 |
GP |
186.3 |
L |
11-hydroxyundecanal |
C(CCCCCO)CCCCC=O |
ROCP4ALK |
Alkane-like ROC species with C* of 10+4 μg m-3 |
G |
254.5 |
L |
Octadecane |
|
ROCP4ALKP |
Peroxy radicals from ROCP4ALK oxidation |
G |
285.49 |
L |
octadecan-3-ylperoxy |
CCCCCCCCCCCCCCCC(CC)O[O] |
ROCP4ALKP2 |
Hydroxy peroxy radicals from ROCP4ALK alkoxy product |
G |
301.49 |
L |
(3-hydroxyoctadecan-6-yl)peroxy |
CCCCCCCCCCCCC(O[O])CCC(O)CC |
ROCP4OXY2 |
Oxygenated ROC species with C* of 10+4 μg m-3 and O:C of 0.2 |
G |
158.2 |
L |
2-Ethylheptanoic Acid |
|
ROCP5ALK |
Alkane-like ROC species with C* of 10+5 μg m-3 |
G |
198.39 |
L |
Tetradecane |
|
ROCP5ALKP |
Peroxy radicals from ROCP5ALK oxidation |
G |
229.38 |
L |
tetradecan-3-ylperoxy |
CCCCCCCCCCCC(CC)O[O] |
ROCP5ALKP2 |
Hydroxy peroxy radicals from ROCP5ALK alkoxy product |
G |
245.38 |
L |
(3-hydroxytetradecan-6-yl)peroxy |
CCCCCCCCC(O[O])CCC(O)CC |
ROCP5ARO |
Aromatic ROC species with C* of 10+5 μg m-3 |
G |
190.33 |
L |
Benzene, octyl- |
|
ROCP5AROP |
Peroxy radicals from ROCP5ARO oxidation |
G |
271.33 |
L |
{8-hydroxy-5-octyl-6,7-dioxabicyclo[3.2.1]oct-3-en-2-yl}peroxy |
CCCCCCCCC1(OO2)C=CC(O[O])C2C1O |
ROCP5OXY1 |
Oxygenated ROC species with C* of 10+5 μg m-3 and O:C of 0.1 |
G |
170.3 |
L |
Undecanal |
|
ROCP6ALK |
Alkane-like ROC species with C* of 10+6 μg m-3 |
G |
184.37 |
L |
Tridecane |
|
ROCP6ALKP |
Peroxy radicals from ROCP6ALK oxidation |
G |
215.36 |
L |
tridecan-3-ylperoxy |
CCCCCCCCCCC(CC)O[O] |
ROCP6ALKP2 |
Hydroxy peroxy radicals from ROCP6ALK alkoxy product |
G |
231.36 |
L |
(3-hydroxytridecan-6-yl)peroxy |
CCCCCCCC(O[O])CCC(O)CC |
ROCP6ARO |
Aromatic ROC species with C* of 10+6 μg m-3 |
G |
176.3 |
L |
1-Hexyl-4-methylbenzene |
|
ROCP6AROP |
Peroxy radicals from ROCP6ARO oxidation |
G |
257.3 |
L |
{2-hexyl-8-hydroxy-5-methyl-6,7-dioxabicyclo[3.2.1]oct-3-en-2-yl}peroxy |
OC1C2C(CCCCCC)(O[O])C=CC1(C)OO2 |
ROCP6OXY1 |
Oxygenated ROC species with C* of 10+6 μg m-3 and O:C of 0.1 |
G |
142.2 |
L |
Nonanal |
|
ROH |
C3 and higher alcohols |
G |
60.0 |
L |
Propanol |
|
SESQ |
Sesquiterpenes |
G |
204.4 |
L |
b-caryophyllene |
|
SESQNRO2 |
Peroxy radicals from SESQ reaction with nitrate radicals |
G |
298.4 |
L |
[4,11,11-trimethyl-8-methylidene-5-(nitrooxy)bicyclo[7.2.0]undecan-4-yl]peroxy |
[O]OC1(C)CCC2C(CC2(C)C)C(=C)CCC1O[N+](=O)[O-] |
SESQRO2 |
Peroxy radicals from SESQ reaction with OH |
G |
253.4 |
L |
{5-hydroxy-4,11,11-trimethyl-8-methylidenebicyclo[7.2.0]undecan-4-yl}peroxy |
[O]OC1(C)CCC2C(CC2(C)C)C(=C)CCC1O |
SLOWROC |
Slowly reacting ROC with kOH< 3.5x10-13 cm3 s-1 |
G |
75.4 |
L |
Hydrogen cyanide |
|
SO2 |
Sulfur dioxide |
G |
64.0 |
E |
Sulfur dioxide |
|
SRF |
Surface area of particles |
P |
1.0 |
L |
Surface area of particles |
|
SULF |
Sulfuric acid |
G |
98.0 |
E |
Sulfuric acid |
|
SULRXN |
Precursor of Aerosol Sulfate (tracking species) |
G |
98.0 |
NA |
||
TOL |
Toluene |
G |
92.14 |
E |
Toluene |
|
TOLP |
Peroxy radicals formed from TOL |
G |
173.14 |
L |
{8-hydroxy-5-methyl-6,7-dioxabicyclo[3.2.1]oct-3-en-2-yl}peroxy |
[O]OC1C=CC2(C)OOC1C2O |
TRPN |
Terpene nitrates |
G |
215.0 |
L |
3-hydroxy-2,6,6-trimethylbicyclo[3.1.1]heptan-2-yl nitrate |
O=N(=O)OC1(C)C(O)CC2CC1C2(C)C |
UALD |
Unsaturated aldehydes |
G |
84.1 |
L |
2-Methylbut-2-enal |
|
UALP |
Peroxy radicals formed from UALD |
G |
133.0 |
L |
(3-hydroxy-3-methyl-4-oxobutan-2-yl)peroxy |
CC(O[O])C(C)(O)C=O |
XO2 |
Accounts for addition NO to NO2 conversions (tracking species) |
G |
1.0 |
NA |
||
XYE |
O- and p-xylene and other less reactive volatile aromatics with kOH < 1.46x10-11 cm3 s-1 |
G |
106.2 |
L |
Ethylbenzene |
|
XYEP |
Peroxy radicals formed from XYE |
G |
187.17 |
L |
{5-ethyl-8-hydroxy-6,7-dioxabicyclo[3.2.1]oct-3-en-2-yl}peroxy |
[O]OC1C=CC2(CC)OOC1C2O |
XYM |
M-xylene and other more reactive volatile aromatics with kOH > 1.46x10-11 cm3 s-1 |
G |
106.2 |
L |
m-Xylene |
|
XYMP |
Peroxy radicals formed from XYM |
G |
187.17 |
L |
{8-hydroxy-1,5-dimethyl-6,7-dioxabicyclo[3.2.1]oct-3-en-2-yl}peroxy |
[O]OC1C=CC2(C)OOC1(C)C2O |