joergklausen
commented
3 years ago Branch confirmed
Closed fstuerzl closed 2 years ago
joergklausen
commented
3 years ago Branch confirmed
rhornbrook
commented
3 years ago For \Atmosphere\Gas\Greenhouse Gas\NF3 (nitrogen trifluoride), add tags "inorganic", "N species"
For \Atmosphere\Gas\Greenhouse Gas\CH3D (deuterated methane, methane-d), add tags organic, and isotopologue, if and per suggestion: https://github.com/wmo-im/wmds/issues/261#issuecomment-836737092
rhornbrook
commented
3 years ago Do we want to remove the "\Greenhouse Gas\CFCs\", "\Greenhouse Gas\HCFCs\", "\Greenhouse Gas\HCFCs\", etc. components of all the paths? Wasn't that the idea behind implementing tags?
joergklausen
commented
3 years ago Yes, indeed. I have corrected the proposal accordingly.
rhornbrook
commented
3 years ago Can I write suggested recommendations for new variables with new ids here? I'm not sure how to do this otherwise... Let me know if there is a better method.
All are in /Atmosphere/Gas phase/
new id C3H8O (1-propanol), CAS: 71-23-8, IUPAC: Propan-1-ol, PubChem CID: 1031, tags: organic, alcohol new id C3H8O (2-propanol), CAS: 67-63-0, IUPAC: Propan-2-ol, PubChem CID: 3776, tags: organic, alcohol new id C4H4O (furan), CAS: 110-00-9, IUPAC: Furan, PubChem CID: 8029, tags: organic, OVOC, aromatic new id C5H6O (2-methylfuran), CAS: 534-22-5, IUPAC: 2-Methylfuran, PubChem CID: 10797, tags: organic, OVOC, aromatic new id C5H6O (3-methylfuran), CAS: 930-27-8, IUPAC: 3-Methylfuran, PubChem CID: 13587, tags: organic, OVOC, aromatic new id C3H3N (2-propenenitrile, acrylonitrile), CAS: 107-13-1, IUPAC: Prop-2-enenitrile, PubChem CID: 7855, tags: organic, N species, nitrile new id C3H5N (propanenitrile), CAS: 107-12-0, IUPAC: Propanenitrile, PubChem CID: 7854, tags: organic, N species, nitrile new id C4H5N (2-methyl-2-propenenitrile, methylacrylonitrile), CAS: 126-98-7, IUPAC: 2-Methylprop-2-enenitrile, PubChem CID: 31368, tags: organic, N species, nitrile
new id CH3NO3 (methyl nitrate), CAS: 598-58-3, IUPAC: Methyl nitrate, PubChem CID: 11724, tags: organic, N species, nitrate new id C2H5NO3 (ethyl nitrate), CAS: 625-58-1, IUPAC: Ethyl nitrate, PubChem CID: 12259, tags: organic, N species, nitrate new id C3H7NO3 (isopropyl nitrate), CAS: 1712-64-7, IUPAC: Propan-2-yl nitrate, PubChem CID: 15575, tags: organic, N species, nitrate new id C4H9NO3 (n-butyl nitrate), CAS: 928-45-0, IUPAC: Butyl nitrate, PubChem CID: 13567, tags: organic, N species, nitrate new id C4H9NO3 (isobutyl nitrate), CAS: 928-45-0, IUPAC: 2-Methylpropyl nitrate, PubChem CID: 10974, tags: organic, N species, nitrate new id C4H9NO3 (t-butyl nitrate), CAS: 540-80-7, IUPAC: tert-Butyl nitrite, PubChem CID: 10906 , tags: organic, N species, nitrate new id C4H9NO3 (2-butyl nitrate, sec-butyl nitrate), CAS: 924-43-6, IUPAC: Butan-2-yl nitrite, PubChem CID: 13544, tags: organic, N species, nitrate new id C5H10O (2-methyl-3-buten-2-ol), CAS: 115-18-4, IUPAC: 2-Methylbut-3-en-2-ol, PubChem CID: 8257, tags: organic, OVOC, BVOC, alcohol new id C8H18 (n-octane), CAS: 111-65-9, IUPAC: Octane, PubChem CID: 356, tags: organic, alkane new id C8H18 (2,2,4-trimethylpentane), CAS: 540-84-1, IUPAC: 2,2,4-Trimethylpentane, PubChem CID: 10907, tags: organic, alkane new id C4H6O ((E)-crotonaldehyde, trans-2-butenal), CAS: 123-73-9, IUPAC: (2E)-but-2-enal, PubChem CID: 447466, tags: organic, aldehyde, alkene, OVOC, specified stereoisomer new id C4H6O ((Z)-crotonaldehyde, cis-2-butenal), CAS: 15798-64-8, IUPAC: (Z)-but-2-enal, PubChem CID: 673950, tags: organic, aldehyde, alkene, OVOC, specified stereoisomer new id C4H6O (crotonaldehyde, 2-butenal), CAS: 4170-30-3, IUPAC: But-2-enal, PubChem CID: 20138, tags: organic, aldehyde, alkene, OVOC, mixed stereoisomers new id C2H2Cl2 (1,1-dichloroethene), CAS: 75-35-4, IUPAC: 1,1-Dichloroethene, PubChem CID: 6366, tags: organic, halocarbon, Cl species new id C2H2Cl2 ((Z)-1,2-dichloroethene, cis-1,2-dichloroethene), CAS: 156-59-2, IUPAC: (Z)-1,2-dichloroethene, PubChem CID: 643833, tags: organic, halocarbon, Cl species, specified stereoisomer new id C2H2Cl2 ((E)-1,2-dichloroethene, trans-1,2-dichloroethene), CAS: 156-60-5, IUPAC: (E)-1,2-dichloroethene, PubChem CID: 638186, tags: organic, halocarbon, Cl species, specified stereoisomer new id C2H2Cl2 ((E/Z)-1,2-dichloroethene), CAS: 540-9-0, IUPAC: 1,2-dichloroethene, PubChem CID: 10900, tags: organic, halocarbon, Cl species, mixed stereoisomers new id C2H4Cl2 (1,1-dichloroethane), CAS: 75-34-3, IUPAC: 1,1-Dichloroethane, PubChem CID: 6365, tags: organic, halocarbon, Cl species new id C2H4Cl2 (1,2-dichloroethane), CAS: 107-06-2, IUPAC: 1,2-Dichloroethane, PubChem CID: 11, tags: organic, halocarbon, Cl species
proposed changes: (for the first three, this is to be consistent with IUPAC names dichloromethane, dibromomethane and diiodomethane)
279, CH3Br (methylbromide) --> change to: CH3Br (bromomethane) 280, CH3Cl (methylchloride) --> change to: CH3Br (chloromethane) 281, CH3I (methyiodide) --> change to: CH3I (iodomethane) 594, CCl4 (carbon tetrachloride) --> change to: CCl4 (tetrachloromethane, carbon tetrachloride) 595, CH3CCl3 (1,1,1-trichloroethane) --> change to: C2H3Cl3 (1,1,1-trichloroethane, methyl chloroform)*
*to be consistent with using the chemical formulae and not the structural formulae, and to include methyl chloroform, which is a commonly used term.
fstuerzl
commented
3 years ago @rhornbrook, I have updated the proposal above with your suggestions.
To do in WG-ACV:
dkubisti
commented
3 years ago Remark to variable CH3D: variable names deuterated methane, methane-d are not unique - unclear are the number of deuteriums. Suggested change to mondeuterated methane, methane-d1
dkubisti
commented
3 years ago I confirm names, IUPAC, PubChem CID and CAS number for following new variables (WDCGG): NF3,, CClF3, C2HClF4, C5H2F10, C4F8. For CH3D s. comment above regarding variable name, IUPAC, PubChem, CAS are fine.
Add tag "Halocarbon" to following species CClF3, C2HClF4, C5H2F10, C4F8.
rhornbrook
commented
3 years ago In the above, C3H3N (2-propenenitrile acrylonitrile) should be changed to: C3H3N (2-propenenitrile, acrylonitrile)
rhornbrook
commented
3 years ago Do we want the tags to be plural? I.e., CFC or CFCs? VOC or VOCs?
My preference would be for not plural, CFC, VOC, OVOC, etc.
fstuerzl
commented
3 years ago In the above, C3H3N (2-propenenitrile acrylonitrile) should be changed to: C3H3N (2-propenenitrile, acrylonitrile)
updated in the proposal!
dkubisti
commented
3 years ago I agree - my preference is also non plural for tags
rhornbrook
commented
3 years ago per our discussion earlier today, in the table above,
C2H2Cl2 ((E/Z)-1,2-dichloroethene) should be changed to; C2H2Cl2 (1,2-dichloroethene)
rhornbrook
commented
3 years ago more species to add to the table:
new id CHBr2Cl (dibromochloromethane), CAS: 124-48-1, IUPAC: dibromo(chloro)methane, PubChem CID: 31296, tags: organic, halocarbon new id CHBrCl2 (bromodichloromethane), CAS: 75-27-4, IUPAC: bromo(dichloro)methane, PubChem CID: 6359, tags: organic, halocarbon new id CH2ClI (chloroiodomethane), CAS: 593-71-5, IUPAC: chloro(iodo)methane, PubChem CID: 11644, tags: organic, halocarbon new id CH2I2 (diiodomethane), CAS: 75-11-6, IUPAC: diiodomethane, PubChem CID: 6346, tags: organic, halocarbon new id C5H4O2 (furfural), CAS: 98-01-1, IUPAC: furan-2-carbaldehyde, PubChem CID: 7362, tags: organic, OVOC, aromatic new id C5H4O2 (3-furaldehyde), CAS: 498-60-2, IUPAC: furan-3-carbaldehyde, PubChem CID: 10351, tags: organic, OVOC, aromatic new id C8H8 (styrene), CAS: 100-42-5, IUPAC: styrene, PubChem CID: 7501, tags: organic, aromatic new id C8H6 (ethynylbenzene), CAS: 536-74-3, IUPAC: ethynylbenzene, PubChem CID: 10821, tags: organic, aromatic new id C6H5Cl (chlorobenzene), CAS: 108-90-7, IUPAC: chlorobenzene, PubChem CID: 7964, tags: organic, aromatic, halocarbon new id C10H16 (tricyclene), CAS: 508-32-7, IUPAC: 1,7,7-trimethyltricyclo[2.2.1.02,6]heptane, PubChem CID: 79035, tags: organic, terpene new id C10H16 (alpha-pinene), CAS: 80-56-8, IUPAC: 2,6,6-trimethylbicyclo[3.1.1]hept-2-ene, PubChem CID: 6654, tags: organic, terpene new id C10H16 (beta-pinene), CAS: 127-91-3, IUPAC: 6,6-dimethyl-2-methylidenebicyclo[3.1.1]heptane, PubChem CID: 14896, tags: organic, terpene new id C10H16 (myrcene), CAS: 123-35-3, IUPAC: 7-methyl-3-methylideneocta-1,6-diene, PubChem CID: 31253, tags: organic, terpene new id C10H16 (camphene), CAS: 79-92-5, IUPAC: 2,2-dimethyl-3-methylidenebicyclo[2.2.1]heptane, PubChem CID: 6616, tags: organic, terpene new id C10H16 (D-limonene), CAS: 5989-27-5, IUPAC: (4R)-1-methyl-4-prop-1-en-2-ylcyclohexene, PubChem CID: 440917, tags: organic, terpene new id C10H16 (3-carene), CAS: 13466-78-9, IUPAC: 3,7,7-trimethylbicyclo[4.1.0]hept-3-ene, PubChem CID: 26049, tags: organic, terpene new id C2H2O2 (glyoxal), CAS: 107-22-2, IUPAC: oxaldehyde, PubChem CID: 7860, tags: organic, OVOC, aldehyde new id C2H4O2 (methyl formate), CAS: 107-31-3, IUPAC: methyl formate, PubChem CID: 7865, tags: organic, OVOC, ester new id C2H4O2 (glycolaldehyde), CAS: 141-46-8, IUPAC: 2-hydroxyacetaldehyde, PubChem CID: 756, tags: organic, OVOC, aldehyde new id C3H6O2 (methyl acetate), CAS: 79-20-9, IUPAC: methyl acetate, PubChem CID: 6584, tags: organic, OVOC, ester new id C3H6O2 (ethyl formate), CAS: 109-94-4, IUPAC: ethyl formate, PubChem CID: 8025, tags: organic, OVOC, ester new id C3H6O2 (hydroxyacetone), CAS: 116-09-6, IUPAC: 1-hydroxypropan-2-one, PubChem CID: 8299, tags: organic, OVOC, ketone new id C3H6O2 (1,3-dioxolane), CAS: 646-06-0, IUPAC: 1,3-dioxolane, PubChem CID: 12586, tags: organic, OVOC new id C4H8O2 (ethyl acetate), CAS: 141-78-6, IUPAC: ethyl acetate, PubChem CID: 8857, tags: organic, OVOC, ester new id C4H8O2 (methyl propionate), CAS: 554-12-1, IUPAC: methyl propanoate, PubChem CID: 11124, tags: organic, OVOC, ester
fstuerzl
commented
3 years ago Proposal and branch is updated. See: https://github.com/wmo-im/wmds/blob/issue275/tables_en/1-01-01.csv
rhornbrook
commented
3 years ago I just noticed that there is an entry for o-xylene, m-xylene, and p,m-xylene. I assume the latter is the mixed p-xylene + m-xylene, which should perhaps be indicated somehow in the variable name, perhaps "C8H10 (p-xylene+m-xylene)"? (with tag "mixed structural isomers", perhaps?)
Regardless, there should be a standalone "C8H10 (p-xylene)" on its own, too.
dkubisti
commented
3 years ago I am sorry, I had a typo for variable CH3D. Name is monodeuterated methane not mondeutorated methane.
dkubisti
commented
3 years ago I agree to add the mixture "C8H10 (p-xylene+m-xylene)" with the synonym "Benzene, 1,3(or 1,4)-dimethyl-"
and to add "C8H10 (p-xylene)", CAS no: 106-42-3, IUPAC:1,4-xylene, PubChem CID:7809, tags: organic, aromatic "C8H10 (m-xylene)", CAS no: 108-38-3, IUPAC:1,3-xylene, PubChem CID:7929, tags: organic, aromatic "C8H10 (m-xylene)", CAS no: 95-47-6, IUPAC:1,2-xylene, PubChem CID:7237, tags: organic, aromatic
fstuerzl
commented
3 years ago I am sorry, I had a typo for variable CH3D. Name is monodeuterated methane not mondeutorated methane.
-> Corrected.
I agree to add the mixture "C8H10 (p-xylene+m-xylene)" with the synonym "Benzene, 1,3(or 1,4)-dimethyl-"
and to add "C8H10 (p-xylene)", CAS no: 106-42-3, IUPAC:1,4-xylene, PubChem CID:7809, tags: organic, aromatic "C8H10 (m-xylene)", CAS no: 108-38-3, IUPAC:1,3-xylene, PubChem CID:7929, tags: organic, aromatic "C8H10 (m-xylene)", CAS no: 95-47-6, IUPAC:1,2-xylene, PubChem CID:7237, tags: organic, aromatic
-> Variable name for p,m-xylene corrected, p-xylene added as a new variable. The other two (1,2 and 1,3-xylene) are already in the list (notation: 485 and 484).
Branch https://github.com/wmo-im/wmds/blob/issue275/tables_en/1-01-01.csv is updated.
joergklausen
commented
3 years ago @fstuerzl Pending tags/matrix
fstuerzl
commented
3 years ago Tags for new variables added in second column, matrix included in description, see: https://github.com/wmo-im/wmds/blob/issue275/tables_en/1-01-01.csv
fstuerzl
commented
3 years ago Branch https://github.com/wmo-im/wmds/blob/issue275/tables_en/1-01-01.csv
Summary and Purpose Variables for greenhouse gases from WDCGG gas species code(https://gaw.kishou.go.jp/documents/db_list/gas_species) and other chemical species are missing in table 1-01-01.csv and there are some minor corrections of existing variables needed.
Stakeholder(s) WDCGG, WG-ACV
| Proposal Add the following variables (from WDCGG): | notation | name | description | domain | matrix | tags |
|---|---|---|---|---|---|---|
| new id | NF3 (nitrogen trifluoride) | IUPAC: nitrogen trifluoride, PubChem CID: 24553, CAS Number: 7783-54-2, in gas phase | Atmosphere | Gas phase | Greenhouse Gas, Inorganic, N species | |
| new id | CH3D (monodeuterated methane, methane-d1) | IUPAC: deuteriomethane, PubChem CID: 12669, CAS Number: 676-49-3, in gas phase | Atmosphere | Gas phase | Greenhouse Gas, Organic, Isotopologue | |
| new id | CClF3 (chlorotrifluoromethane, CFC-13) | IUPAC: chloro(trifluoro)methane, PubChem CID: 6392, CAS Number: 75-72-9, in gas phase | Atmosphere | Gas phase | Greenhouse Gas, CFCs, Organic, Halocarbon | |
| new id | C2HClF4 (1-chloro-1,2,2,2-tetrafluoroethane, HCFC-124) | IUPAC: 2-chloro-1,1,1,2-tetrafluoroethane, PubChem CID: 17822, CAS Number: 2837-89-0, in gas phase | Atmosphere | Gas phase | Greenhouse Gas, HCFCs, Organic, Halocarbon | |
| new id | C5H2F10 (1,1,1,2,2,3,4,5,5,5-decafluoropentane, HFC-43-10-mee) | IUPAC: 1,1,1,2,2,3,4,5,5,5-decafluoropentane, PubChem CID: 86240, CAS Number: 138495-42-8, in gas phase | Atmosphere | Gas phase | Greenhouse Gas, HFCs, Organic, Halocarbon | |
| new id | C4F8 (octafluorocyclobutane, PFC-318) | IUPAC: 1,1,2,2,3,3,4,4-octafluorocyclobutane, PubChem CID: 8263, CAS Number: 115-25-3, in gas phase | Atmosphere | Gas phase | Greenhouse Gas, PFCs, Organic, Halocarbon |
| Add the following variables (from WG-ACV): notation | name | description | tags |
|---|---|---|---|
| new id | C3H8O (1-propanol) | IUPAC: Propan-1-ol, PubChem CID: 1031, CAS Number: 71-23-8, in gas phase | organic, alcohol |
| new id | C3H8O (2-propanol) | IUPAC: Propan-2-ol, PubChem CID: 3776, CAS Number: 67-63-0, in gas phase | organic, alcohol |
| new id | C4H4O (furan) | IUPAC: Furan, PubChem CID: 8029, CAS Number: 110-00-9, in gas phase | organic, OVOC, aromatic |
| new id | C5H6O (2-methylfuran) | IUPAC: 2-Methylfuran, PubChem CID: 10797, CAS Number: 534-22-5, in gas phase | organic, OVOC, aromatic |
| new id | C5H6O (3-methylfuran) | IUPAC: 3-Methylfuran, PubChem CID: 13587, CAS Number: 930-27-8, in gas phase | organic, OVOC, aromatic |
| new id | C3H3N (2-propenenitrile, acrylonitrile) | IUPAC: Prop-2-enenitrile, PubChem CID: 7855, CAS Number: 107-13-1, in gas phase | organic, N species, nitrile |
| new id | C3H5N (propanenitrile) | IUPAC: Propanenitrile, PubChem CID: 7854, CAS Number: 107-12-0, in gas phase | organic, N species, nitrile |
| new id | C4H5N (2-methyl-2-propenenitrile, methylacrylonitrile) | IUPAC: 2-Methylprop-2-enenitrile, PubChem CID: 31368, CAS Number: 126-98-7, in gas phase | organic, N species, nitrile |
| new id | CH3NO3 (methyl nitrate) | IUPAC: Methyl nitrate, PubChem CID: 11724, CAS Number: 598-58-3, in gas phase | organic, N species, nitrate |
| new id | C2H5NO3 (ethyl nitrate) | IUPAC: Ethyl nitrate, PubChem CID: 12259, CAS Number: 625-58-1, in gas phase | organic, N species, nitrate |
| new id | C3H7NO3 (isopropyl nitrate) | IUPAC: Propan-2-yl nitrate, PubChem CID: 15575, CAS Number: 1712-64-7, in gas phase | organic, N species, nitrate |
| new id | C4H9NO3 (n-butyl nitrate) | IUPAC: Butyl nitrate, PubChem CID: 13567, CAS Number: 928-45-0, in gas phase | organic, N species, nitrate |
| new id | C4H9NO3 (isobutyl nitrate) | IUPAC: 2-Methylpropyl nitrate, PubChem CID: 10974, CAS Number: 928-45-0, in gas phase | organic, N species, nitrate |
| new id | C4H9NO3 (t-butyl nitrate) | IUPAC: tert-Butyl nitrite, PubChem CID: 10906, CAS Number: 540-80-7, in gas phase | organic, N species, nitrate |
| new id | C4H9NO3 (2-butyl nitrate, sec-butyl nitrate) | IUPAC: Butan-2-yl nitrite, PubChem CID: 13544, CAS Number: 924-43-6, in gas phase | organic, N species, nitrate |
| new id | C5H10O (2-methyl-3-buten-2-ol) | IUPAC: 2-Methylbut-3-en-2-ol, PubChem CID: 8257, CAS Number: 115-18-4, in gas phase | organic, OVOC, BVOC, alcohol |
| new id | C8H18 (n-octane) | IUPAC: Octane, PubChem CID: 356, CAS Number: 111-65-9, in gas phase | organic, alkane |
| new id | C8H18 (2,2,4-trimethylpentane) | IUPAC: 2,2,4-Trimethylpentane, PubChem CID: 10907, CAS Number: 540-84-1, in gas phase | organic, alkane |
| new id | C4H6O ((E)-crotonaldehyde, trans-2-butenal) | IUPAC: (2E)-but-2-enal, PubChem CID: 447466, CAS Number: 123-73-9, in gas phase | organic, aldehyde, alkene, OVOC, specified stereoisomer |
| new id | C4H6O ((Z)-crotonaldehyde, cis-2-butenal) | IUPAC: (Z)-but-2-enal, PubChem CID: 673950, CAS Number: 15798-64-8, in gas phase | organic, aldehyde, alkene, OVOC, specified stereoisomer |
| new id | C4H6O (crotonaldehyde, 2-butenal) | IUPAC: But-2-enal, PubChem CID: 20138, CAS Number: 4170-30-3, in gas phase | organic, aldehyde, alkene, OVOC, mixed stereoisomers |
| new id | C2H2Cl2 (1,1-dichloroethene) | IUPAC: 1,1-Dichloroethene, PubChem CID: 6366, CAS Number: 75-35-4, in gas phase | organic, halocarbon, Cl species |
| new id | C2H2Cl2 ((Z)-1,2-dichloroethene, cis-1,2-dichloroethene) | IUPAC: (Z)-1,2-dichloroethene, PubChem CID: 643833, CAS Number: 156-59-2, in gas phase | organic, halocarbon, Cl species, specified stereoisomer |
| new id | C2H2Cl2 ((E)-1,2-dichloroethene, trans-1,2-dichloroethene) | IUPAC: (E)-1,2-dichloroethene, PubChem CID: 638186, CAS Number: 156-60-5, in gas phase | organic, halocarbon, Cl species, specified stereoisomer |
| new id | C2H2Cl2 (1,2-dichloroethene) | IUPAC: 1,2-dichloroethene, PubChem CID: 10900, CAS Number: 540-9-0, in gas phase | organic, halocarbon, Cl species, mixed stereoisomers |
| new id | C2H4Cl2 (1,1-dichloroethane) | IUPAC: 1,1-Dichloroethane, PubChem CID: 6365, CAS Number: 75-34-3, in gas phase | organic, halocarbon, Cl species |
| new id | C2H4Cl2 (1,2-dichloroethane) | IUPAC: 1,2-Dichloroethane, PubChem CID: 11, CAS Number: 107-06-2, in gas phase | organic, halocarbon, Cl species |
| new id | CHBr2Cl (dibromochloromethane) | IUPAC: dibromo(chloro)methane, PubChem CID: 31296, CAS Number: 124-48-1, in gas phase | organic, halocarbon |
| new id | CHBrCl2 (bromodichloromethane) | IUPAC: bromo(dichloro)methane, PubChem CID: 6359, CAS Number: 75-27-4, in gas phase | organic, halocarbon |
| new id | CH2ClI (chloroiodomethane) | IUPAC: chloro(iodo)methane, PubChem CID: 11644, CAS Number: 593-71-5, in gas phase | organic, halocarbon |
| new id | CH2I2 (diiodomethane) | IUPAC: diiodomethane, PubChem CID: 6346, CAS Number: 75-11-6, in gas phase | organic, halocarbon |
| new id | C5H4O2 (furfural) | IUPAC: furan-2-carbaldehyde, PubChem CID: 7362, CAS Number: 98-01-1, in gas phase | organic, OVOC, aromatic |
| new id | C5H4O2 (3-furaldehyde) | IUPAC: furan-3-carbaldehyde, PubChem CID: 10351, CAS Number: 498-60-2, in gas phase | organic, OVOC, aromatic |
| new id | C8H8 (styrene) | IUPAC: styrene, PubChem CID: 7501, CAS Number: 100-42-5, in gas phase | organic, aromatic |
| new id | C8H6 (ethynylbenzene) | IUPAC: ethynylbenzene, PubChem CID: 10821, CAS Number: 536-74-3, in gas phase | organic, aromatic |
| new id | C6H5Cl (chlorobenzene) | IUPAC: chlorobenzene, PubChem CID: 7964, CAS Number: 108-90-7, in gas phase | organic, aromatic, halocarbon |
| new id | C10H16 (tricyclene) | IUPAC: 1,7,7-trimethyltricyclo[2.2.1.02,6]heptane, PubChem CID: 79035, CAS Number: 508-32-7, in gas phase | organic, terpene |
| new id | C10H16 (alpha-pinene) | IUPAC: 2,6,6-trimethylbicyclo[3.1.1]hept-2-ene, PubChem CID: 6654, CAS Number: 80-56-, in gas phase8 | organic, terpene |
| new id | C10H16 (beta-pinene) | IUPAC: 6,6-dimethyl-2-methylidenebicyclo[3.1.1]heptane, PubChem CID: 14896, CAS Number: 127-91-3, in gas phase | organic, terpene |
| new id | C10H16 (myrcene) | IUPAC: 7-methyl-3-methylideneocta-1, PubChem CID: 31253, CAS Number: 123-35-3, in gas phase | organic, terpene |
| new id | C10H16 (camphene) | IUPAC: 2,2-dimethyl-3-methylidenebicyclo[2.2.1]heptane, PubChem CID: 6616, CAS Number: 79-92-5, in gas phase | organic, terpene |
| new id | C10H16 (D-limonene) | IUPAC: (4R)-1-methyl-4-prop-1-en-2-ylcyclohexene, PubChem CID: 440917, CAS Number: 5989-27-5, in gas phase | organic, terpene |
| new id | C10H16 (3-carene) | IUPAC: 3,7,7-trimethylbicyclo[4.1.0]hept-3-ene, PubChem CID: 26049, CAS Number: 13466-78-9, in gas phase | organic, terpene |
| new id | C2H2O2 (glyoxal) | IUPAC: oxaldehyde, PubChem CID: 7860, CAS Number: 107-22-2, in gas phase | organic, OVOC, aldehyde |
| new id | C2H4O2 (methyl formate) | IUPAC: methyl formate, PubChem CID: 7865, CAS Number: 107-31-3, in gas phase | organic, OVOC, ester |
| new id | C2H4O2 (glycolaldehyde) | IUPAC: 2-hydroxyacetaldehyde, PubChem CID: 756, CAS Number: 141-46-8, in gas phase | organic, OVOC, aldehyde |
| new id | C3H6O2 (methyl acetate) | IUPAC: methyl acetate, PubChem CID: 6584, CAS Number: 79-20-9, in gas phase | organic, OVOC, ester |
| new id | C3H6O2 (ethyl formate) | IUPAC: ethyl formate, PubChem CID: 8025, CAS Number: 109-94-4, in gas phase | organic, OVOC, ester |
| new id | C3H6O2 (hydroxyacetone) | IUPAC: 1-hydroxypropan-2-one, PubChem CID: 8299, CAS Number: 116-09-6, in gas phase | organic, OVOC, ketone |
| new id | C3H6O2 (1,3-dioxolane) | IUPAC: 1,3-dioxolane, PubChem CID: 12586, CAS Number: 646-06-0, in gas phase | organic, OVOC |
| new id | C4H8O2 (ethyl acetate) | IUPAC: ethyl acetate, PubChem CID: 8857, CAS Number: 141-78-6, in gas phase | organic, OVOC, ester |
| new id | C4H8O2 (methyl propionate) | IUPAC: methyl propanoate, PubChem CID: 11124, CAS Number: 554-12-1, in gas phase | organic, OVOC, ester |
| new id | C8H10 (p-xylene) | IUPAC: 1,4-xylene, PubChem CID: 7809, CAS Number: 106-42-3, in gas phase | gas phase, organic, aromatic |
Implement the following corrections:
| notation | name(old) | name (new) | descriptions (new) |
|---|---|---|---|
| 192 | CH4 | CH4 (methane) | IUPAC: methane, PubChem CID: 297, CAS Number: 74-82-8, in gas phase |
| 557 | C3H2F6 (1,1,1,2,3,3-hexafluoropropane, HFC-236fa) | C3H2F6 (1,1,1,2,3,3-hexafluoropropane, HFC-236ea) | IUPAC: 1,1,1,2,3,3-hexafluoropropane, PubChem CID: 79009, CAS Number: 431-63-0, in gas phase |
| 279 | CH3Br (methylbromide) | CH3Br (bromomethane) | IUPAC: bromomethane, PubChem CID: 6323, CAS Number: 74-83-9, in gas phase |
| 280 | CH3Cl (methylchloride) | CH3Cl (chloromethane) | IUPAC: chloromethane, PubChem CID: 6327, CAS Number: 74-87-3, in gas phase |
| 281 | CH3I (methyiodide) | CH3I (iodomethane) | IUPAC: iodomethane, PubChem CID: 6328, CAS Number: 74-88-4, in gas phase |
| 594 | CCl4 (carbon tetrachloride) | CCl4 (tetrachloromethane, carbon tetrachloride) | IUPAC: tetrachloromethane, PubChem CID: 5943, CAS Number: 56-23-5, in gas phase |
| 595 | CH3CCl3 (1,1,1-trichloroethane) | C2H3Cl3 (1,1,1-trichloroethane, methyl chloroform) | IUPAC: 1,1,1-trichloroethane, PubChem CID: 6278, CAS Number: 71-55-6, in gas phase |
Reason
Branch https://github.com/wmo-im/wmds/blob/issue275/tables_en/1-01-01.csv View differences: https://github.com/wmo-im/wmds/commit/bd22f28cb9e0c7f54f9f13ca4465236be41993ac#diff-160fbee712206a9a655a755c35b0b78b48ab1514bf8937984c6069c5fdf6ba6d
Summary and Purpose Variables for greenhouse gases from WDCGG gas species code(https://gaw.kishou.go.jp/documents/db_list/gas_species) and other chemical species are missing in table 1-01-01.csv and there are some minor corrections of existing variables needed.
Stakeholder(s) WDCGG, WG-ACV
Implement the following corrections:
Reason