← Back to consensus flow objects
Bromocyclohexane
Provenance
| Field | Value |
|---|---|
| Resolver | hybrid_name_cas_v1 |
| Seed Source | EF 3.1 |
| Seed Flow | 2622b5fe-7c0b-4fa1-8dd4-60bb327a9a16 |
Properties
| Predicate | Value |
|---|---|
| InChIKey |
AQNQQHJNRPDOQV-UHFFFAOYSA-N, BTZVDPWKGXMQFW-UHFFFAOYSA-N, XAIPJGJDHUBXQY-UHFFFAOYSA-N
|
| InChI |
InChI=1S/C13H8Cl2N2/c14-10-3-1-8-5-9-2-4-11(15)7-13(9)17-16-12(8)6-10/h1-4,6-7H,5H2, InChI=1S/C15H28O4/c16-14(17)12-10-8-6-4-2-1-3-5-7-9-11-13-15(18)19/h1-13H2,(H,16,17)(H,18,19), InChI=1S/C6H11Br/c7-6-4-2-1-3-5-6/h6H,1-5H2
|
| IUPAC name |
3,8-bis(chloranyl)-11H-benzo[c][1,2]benzodiazepine, 3,8-dichloro-11H-benzo[c][1,2]benzodiazepine, bromanylcyclohexane, bromocyclohexane, pentadecanedioic acid
|
| Molecular formula |
C13H8Cl2N2, C15H28O4, C6H11Br
|
| Molecular mass |
272.385
|
| Monoisotopic mass |
272.198759
|
| SMILES |
C(CCCCCCC(=O)O)CCCCCCC(=O)O, C1C2=C(C=C(C=C2)Cl)N=NC3=C1C=CC(=C3)Cl, C1CCC(CC1)Br, O=C(O)CCCCCCCCCCCCCC(=O)O
|
References
- http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J105.002H
- http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J22.525H
- http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J5.082B
- https://chem.echa.europa.eu/100.003.294
- https://chem.echa.europa.eu/100.204.769
- https://commonchemistry.cas.org/detail?cas_rn=108-85-0
- https://commonchemistry.cas.org/detail?cas_rn=1460-18-0
- https://comptox.epa.gov/dashboard/DTXSID10296477
- https://comptox.epa.gov/dashboard/DTXSID1044148
- https://comptox.epa.gov/dashboard/DTXSID1074337
- https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=109541
- https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=11207
- https://en.wikipedia.org/wiki/Bromocyclohexane
- https://gsrs.ncats.nih.gov/ginas/app/beta/substances/0C9LD26ZA0
- https://gsrs.ncats.nih.gov/ginas/app/beta/substances/YA0UMS4RNY
- https://lipidmaps.org/databases/lmsd/LMFA01170021
- https://pubchem.ncbi.nlm.nih.gov/compound/160576
- https://pubchem.ncbi.nlm.nih.gov/compound/269018
- https://pubchem.ncbi.nlm.nih.gov/compound/7960
- https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:165387
- https://www.metabolomicsworkbench.org/data/StructureData.php?RegNo=1945
- https://www.wikidata.org/wiki/Q72499692
- https://www.wikidata.org/wiki/Q82037103
- https://www.wikidata.org/wiki/Q82427
Linked Elementary Flows
| UUID | Source | Unit | Context | LCIA Factors | Consensus Changes |
|---|---|---|---|---|---|
c52396d0… |
EF 3.1 | kg | Environmental → Air → Aircraft cruise height | 2 | 2 |
61201c95… |
EF 3.1 | kg | Environmental → Air → Ground level → Rural (<1000 people/square mile) | 0 | 2 |
d1d81e18… |
EF 3.1 | kg | Environmental → Air → Ground level → Urban (>1000 people/square mile) | 2 | 2 |
e0d9d3ce… |
EF 3.1 | kg | Environmental → Air → High stack, >150 meters | 2 | 2 |
2e8c8598… |
EF 3.1 | kg | Environmental → Air → Unknown | 2 | 2 |
daa10638… |
EF 3.1 | kg | Environmental → Air → Unknown | 2 | 2 |
7575916a… |
EF 3.1 | kg | Environmental → Ground → Agricultural | 2 | 2 |
2622b5fe… |
EF 3.1 | kg | Environmental → Ground → Unknown | 2 | 2 |
e58593bb… |
EF 3.1 | kg | Environmental → Water → Ocean | 2 | 2 |
4f2e4020… |
EF 3.1 | kg | Environmental → Water → Surface water | 2 | 2 |
3d9822ea… |
EF 3.1 | kg | Environmental → Water → Unknown | 2 | 2 |
▶
Changes Applied
| Elementary Flow | Field | Old Value | New Value | Comment |
|---|---|---|---|---|
2622b5fe… |
altLabel |
— |
[{"@value":"1-Bromocyclohexane","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:108-85-0","https://commonchemistry.cas.org/detail?cas_rn=108-85-0"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"Cyclohexane, bromo-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:108-85-0","https://commonchemistry.cas.org/detail?cas_rn=108-85-0"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"Cyclohexyl bromide","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:108-85-0","https://commonchemistry.cas.org/detail?cas_rn=108-85-0"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"NSC 11207","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:108-85-0","https://commonchemistry.cas.org/detail?cas_rn=108-85-0"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] |
group_key=bromocyclohexane||dimension=Environmental > media=Ground > geography=Unknown; cas=108-85-0; added Common Chemistry CAS names as altLabel: 1-Bromocyclohexane, Cyclohexane, bromo-, Cyclohexyl bromide, NSC 11207; object_uuid=fo-dce5c85070164d8f |
2622b5fe… |
cas_match_labels |
— |
{"108-85-0":"exactMatch"} |
group_key=bromocyclohexane||dimension=Environmental > media=Ground > geography=Unknown; group_sources=['ec_inventory', 'pubchem']; cas_sources={'108-85-0': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-dce5c85070164d8f: {'108-85-0': 'exactMatch'} |
2e8c8598… |
altLabel |
— |
[{"@value":"1-Bromocyclohexane","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:108-85-0","https://commonchemistry.cas.org/detail?cas_rn=108-85-0"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"Cyclohexane, bromo-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:108-85-0","https://commonchemistry.cas.org/detail?cas_rn=108-85-0"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"Cyclohexyl bromide","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:108-85-0","https://commonchemistry.cas.org/detail?cas_rn=108-85-0"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"NSC 11207","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:108-85-0","https://commonchemistry.cas.org/detail?cas_rn=108-85-0"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] |
group_key=bromocyclohexane||dimension=Environmental > media=Ground > geography=Unknown; cas=108-85-0; added Common Chemistry CAS names as altLabel: 1-Bromocyclohexane, Cyclohexane, bromo-, Cyclohexyl bromide, NSC 11207; object_uuid=fo-dce5c85070164d8f |
2e8c8598… |
cas_match_labels |
— |
{"108-85-0":"exactMatch"} |
group_key=bromocyclohexane||dimension=Environmental > media=Ground > geography=Unknown; group_sources=['ec_inventory', 'pubchem']; cas_sources={'108-85-0': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-dce5c85070164d8f: {'108-85-0': 'exactMatch'} |
3d9822ea… |
altLabel |
— |
[{"@value":"1-Bromocyclohexane","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:108-85-0","https://commonchemistry.cas.org/detail?cas_rn=108-85-0"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"Cyclohexane, bromo-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:108-85-0","https://commonchemistry.cas.org/detail?cas_rn=108-85-0"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"Cyclohexyl bromide","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:108-85-0","https://commonchemistry.cas.org/detail?cas_rn=108-85-0"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"NSC 11207","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:108-85-0","https://commonchemistry.cas.org/detail?cas_rn=108-85-0"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] |
group_key=bromocyclohexane||dimension=Environmental > media=Ground > geography=Unknown; cas=108-85-0; added Common Chemistry CAS names as altLabel: 1-Bromocyclohexane, Cyclohexane, bromo-, Cyclohexyl bromide, NSC 11207; object_uuid=fo-dce5c85070164d8f |
3d9822ea… |
cas_match_labels |
— |
{"108-85-0":"exactMatch"} |
group_key=bromocyclohexane||dimension=Environmental > media=Ground > geography=Unknown; group_sources=['ec_inventory', 'pubchem']; cas_sources={'108-85-0': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-dce5c85070164d8f: {'108-85-0': 'exactMatch'} |
4f2e4020… |
altLabel |
— |
[{"@value":"1-Bromocyclohexane","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:108-85-0","https://commonchemistry.cas.org/detail?cas_rn=108-85-0"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"Cyclohexane, bromo-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:108-85-0","https://commonchemistry.cas.org/detail?cas_rn=108-85-0"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"Cyclohexyl bromide","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:108-85-0","https://commonchemistry.cas.org/detail?cas_rn=108-85-0"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"NSC 11207","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:108-85-0","https://commonchemistry.cas.org/detail?cas_rn=108-85-0"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] |
group_key=bromocyclohexane||dimension=Environmental > media=Ground > geography=Unknown; cas=108-85-0; added Common Chemistry CAS names as altLabel: 1-Bromocyclohexane, Cyclohexane, bromo-, Cyclohexyl bromide, NSC 11207; object_uuid=fo-dce5c85070164d8f |
4f2e4020… |
cas_match_labels |
— |
{"108-85-0":"exactMatch"} |
group_key=bromocyclohexane||dimension=Environmental > media=Ground > geography=Unknown; group_sources=['ec_inventory', 'pubchem']; cas_sources={'108-85-0': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-dce5c85070164d8f: {'108-85-0': 'exactMatch'} |
61201c95… |
altLabel |
— |
[{"@value":"1-Bromocyclohexane","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:108-85-0","https://commonchemistry.cas.org/detail?cas_rn=108-85-0"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"Cyclohexane, bromo-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:108-85-0","https://commonchemistry.cas.org/detail?cas_rn=108-85-0"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"Cyclohexyl bromide","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:108-85-0","https://commonchemistry.cas.org/detail?cas_rn=108-85-0"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"NSC 11207","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:108-85-0","https://commonchemistry.cas.org/detail?cas_rn=108-85-0"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] |
group_key=bromocyclohexane||dimension=Environmental > media=Ground > geography=Unknown; cas=108-85-0; added Common Chemistry CAS names as altLabel: 1-Bromocyclohexane, Cyclohexane, bromo-, Cyclohexyl bromide, NSC 11207; object_uuid=fo-dce5c85070164d8f |
61201c95… |
cas_match_labels |
— |
{"108-85-0":"exactMatch"} |
group_key=bromocyclohexane||dimension=Environmental > media=Ground > geography=Unknown; group_sources=['ec_inventory', 'pubchem']; cas_sources={'108-85-0': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-dce5c85070164d8f: {'108-85-0': 'exactMatch'} |
6cebd022… |
altLabel |
— |
[{"@value":"1-Bromocyclohexane","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:108-85-0","https://commonchemistry.cas.org/detail?cas_rn=108-85-0"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"Cyclohexane, bromo-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:108-85-0","https://commonchemistry.cas.org/detail?cas_rn=108-85-0"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"Cyclohexyl bromide","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:108-85-0","https://commonchemistry.cas.org/detail?cas_rn=108-85-0"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"NSC 11207","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:108-85-0","https://commonchemistry.cas.org/detail?cas_rn=108-85-0"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] |
group_key=bromocyclohexane||dimension=Environmental > media=Ground > geography=Unknown; cas=108-85-0; added Common Chemistry CAS names as altLabel: 1-Bromocyclohexane, Cyclohexane, bromo-, Cyclohexyl bromide, NSC 11207; object_uuid=fo-dce5c85070164d8f |
6cebd022… |
cas_match_labels |
— |
{"108-85-0":"exactMatch"} |
group_key=bromocyclohexane||dimension=Environmental > media=Ground > geography=Unknown; group_sources=['ec_inventory', 'pubchem']; cas_sources={'108-85-0': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-dce5c85070164d8f: {'108-85-0': 'exactMatch'} |
7575916a… |
altLabel |
— |
[{"@value":"1-Bromocyclohexane","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:108-85-0","https://commonchemistry.cas.org/detail?cas_rn=108-85-0"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"Cyclohexane, bromo-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:108-85-0","https://commonchemistry.cas.org/detail?cas_rn=108-85-0"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"Cyclohexyl bromide","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:108-85-0","https://commonchemistry.cas.org/detail?cas_rn=108-85-0"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"NSC 11207","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:108-85-0","https://commonchemistry.cas.org/detail?cas_rn=108-85-0"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] |
group_key=bromocyclohexane||dimension=Environmental > media=Ground > geography=Unknown; cas=108-85-0; added Common Chemistry CAS names as altLabel: 1-Bromocyclohexane, Cyclohexane, bromo-, Cyclohexyl bromide, NSC 11207; object_uuid=fo-dce5c85070164d8f |
7575916a… |
cas_match_labels |
— |
{"108-85-0":"exactMatch"} |
group_key=bromocyclohexane||dimension=Environmental > media=Ground > geography=Unknown; group_sources=['ec_inventory', 'pubchem']; cas_sources={'108-85-0': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-dce5c85070164d8f: {'108-85-0': 'exactMatch'} |
93364f47… |
altLabel |
— |
[{"@value":"1-Bromocyclohexane","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:108-85-0","https://commonchemistry.cas.org/detail?cas_rn=108-85-0"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"Cyclohexane, bromo-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:108-85-0","https://commonchemistry.cas.org/detail?cas_rn=108-85-0"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"Cyclohexyl bromide","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:108-85-0","https://commonchemistry.cas.org/detail?cas_rn=108-85-0"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"NSC 11207","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:108-85-0","https://commonchemistry.cas.org/detail?cas_rn=108-85-0"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] |
group_key=bromocyclohexane||dimension=Environmental > media=Ground > geography=Unknown; cas=108-85-0; added Common Chemistry CAS names as altLabel: 1-Bromocyclohexane, Cyclohexane, bromo-, Cyclohexyl bromide, NSC 11207; object_uuid=fo-dce5c85070164d8f |
93364f47… |
cas_match_labels |
— |
{"108-85-0":"exactMatch"} |
group_key=bromocyclohexane||dimension=Environmental > media=Ground > geography=Unknown; group_sources=['ec_inventory', 'pubchem']; cas_sources={'108-85-0': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-dce5c85070164d8f: {'108-85-0': 'exactMatch'} |
c52396d0… |
altLabel |
— |
[{"@value":"1-Bromocyclohexane","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:108-85-0","https://commonchemistry.cas.org/detail?cas_rn=108-85-0"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"Cyclohexane, bromo-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:108-85-0","https://commonchemistry.cas.org/detail?cas_rn=108-85-0"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"Cyclohexyl bromide","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:108-85-0","https://commonchemistry.cas.org/detail?cas_rn=108-85-0"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"NSC 11207","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:108-85-0","https://commonchemistry.cas.org/detail?cas_rn=108-85-0"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] |
group_key=bromocyclohexane||dimension=Environmental > media=Ground > geography=Unknown; cas=108-85-0; added Common Chemistry CAS names as altLabel: 1-Bromocyclohexane, Cyclohexane, bromo-, Cyclohexyl bromide, NSC 11207; object_uuid=fo-dce5c85070164d8f |
c52396d0… |
cas_match_labels |
— |
{"108-85-0":"exactMatch"} |
group_key=bromocyclohexane||dimension=Environmental > media=Ground > geography=Unknown; group_sources=['ec_inventory', 'pubchem']; cas_sources={'108-85-0': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-dce5c85070164d8f: {'108-85-0': 'exactMatch'} |
d1d81e18… |
altLabel |
— |
[{"@value":"1-Bromocyclohexane","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:108-85-0","https://commonchemistry.cas.org/detail?cas_rn=108-85-0"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"Cyclohexane, bromo-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:108-85-0","https://commonchemistry.cas.org/detail?cas_rn=108-85-0"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"Cyclohexyl bromide","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:108-85-0","https://commonchemistry.cas.org/detail?cas_rn=108-85-0"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"NSC 11207","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:108-85-0","https://commonchemistry.cas.org/detail?cas_rn=108-85-0"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] |
group_key=bromocyclohexane||dimension=Environmental > media=Ground > geography=Unknown; cas=108-85-0; added Common Chemistry CAS names as altLabel: 1-Bromocyclohexane, Cyclohexane, bromo-, Cyclohexyl bromide, NSC 11207; object_uuid=fo-dce5c85070164d8f |
d1d81e18… |
cas_match_labels |
— |
{"108-85-0":"exactMatch"} |
group_key=bromocyclohexane||dimension=Environmental > media=Ground > geography=Unknown; group_sources=['ec_inventory', 'pubchem']; cas_sources={'108-85-0': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-dce5c85070164d8f: {'108-85-0': 'exactMatch'} |
daa10638… |
altLabel |
— |
[{"@value":"1-Bromocyclohexane","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:108-85-0","https://commonchemistry.cas.org/detail?cas_rn=108-85-0"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"Cyclohexane, bromo-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:108-85-0","https://commonchemistry.cas.org/detail?cas_rn=108-85-0"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"Cyclohexyl bromide","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:108-85-0","https://commonchemistry.cas.org/detail?cas_rn=108-85-0"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"NSC 11207","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:108-85-0","https://commonchemistry.cas.org/detail?cas_rn=108-85-0"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] |
group_key=bromocyclohexane||dimension=Environmental > media=Ground > geography=Unknown; cas=108-85-0; added Common Chemistry CAS names as altLabel: 1-Bromocyclohexane, Cyclohexane, bromo-, Cyclohexyl bromide, NSC 11207; object_uuid=fo-dce5c85070164d8f |
daa10638… |
cas_match_labels |
— |
{"108-85-0":"exactMatch"} |
group_key=bromocyclohexane||dimension=Environmental > media=Ground > geography=Unknown; group_sources=['ec_inventory', 'pubchem']; cas_sources={'108-85-0': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-dce5c85070164d8f: {'108-85-0': 'exactMatch'} |
e0d9d3ce… |
altLabel |
— |
[{"@value":"1-Bromocyclohexane","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:108-85-0","https://commonchemistry.cas.org/detail?cas_rn=108-85-0"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"Cyclohexane, bromo-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:108-85-0","https://commonchemistry.cas.org/detail?cas_rn=108-85-0"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"Cyclohexyl bromide","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:108-85-0","https://commonchemistry.cas.org/detail?cas_rn=108-85-0"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"NSC 11207","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:108-85-0","https://commonchemistry.cas.org/detail?cas_rn=108-85-0"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] |
group_key=bromocyclohexane||dimension=Environmental > media=Ground > geography=Unknown; cas=108-85-0; added Common Chemistry CAS names as altLabel: 1-Bromocyclohexane, Cyclohexane, bromo-, Cyclohexyl bromide, NSC 11207; object_uuid=fo-dce5c85070164d8f |
e0d9d3ce… |
cas_match_labels |
— |
{"108-85-0":"exactMatch"} |
group_key=bromocyclohexane||dimension=Environmental > media=Ground > geography=Unknown; group_sources=['ec_inventory', 'pubchem']; cas_sources={'108-85-0': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-dce5c85070164d8f: {'108-85-0': 'exactMatch'} |
e58593bb… |
altLabel |
— |
[{"@value":"1-Bromocyclohexane","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:108-85-0","https://commonchemistry.cas.org/detail?cas_rn=108-85-0"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"Cyclohexane, bromo-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:108-85-0","https://commonchemistry.cas.org/detail?cas_rn=108-85-0"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"Cyclohexyl bromide","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:108-85-0","https://commonchemistry.cas.org/detail?cas_rn=108-85-0"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"NSC 11207","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:108-85-0","https://commonchemistry.cas.org/detail?cas_rn=108-85-0"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] |
group_key=bromocyclohexane||dimension=Environmental > media=Ground > geography=Unknown; cas=108-85-0; added Common Chemistry CAS names as altLabel: 1-Bromocyclohexane, Cyclohexane, bromo-, Cyclohexyl bromide, NSC 11207; object_uuid=fo-dce5c85070164d8f |
e58593bb… |
cas_match_labels |
— |
{"108-85-0":"exactMatch"} |
group_key=bromocyclohexane||dimension=Environmental > media=Ground > geography=Unknown; group_sources=['ec_inventory', 'pubchem']; cas_sources={'108-85-0': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-dce5c85070164d8f: {'108-85-0': 'exactMatch'} |
Flow Object JSON
{
"flow_object_id": "fo-dce5c85070164d8f",
"prefLabel": [
{
"@value": "Bromocyclohexane",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "hybrid_name_cas_v1",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"EF 3.1"
],
"prov:wasDerivedFrom": "prefLabel"
}
}
],
"altLabel": [
{
"@value": "1-Bromocyclohexane",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "hybrid_name_cas_v1",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"EF 3.1"
],
"prov:wasDerivedFrom": "altLabel"
}
},
{
"@value": "Cyclohexane, bromo-",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "hybrid_name_cas_v1",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"EF 3.1"
],
"prov:wasDerivedFrom": "altLabel"
}
},
{
"@value": "Cyclohexyl bromide",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "hybrid_name_cas_v1",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"EF 3.1"
],
"prov:wasDerivedFrom": "altLabel"
}
},
{
"@value": "NSC 11207",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "hybrid_name_cas_v1",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"EF 3.1"
],
"prov:wasDerivedFrom": "altLabel"
}
}
],
"properties": {
"https://w3id.org/chemrof/molecular_formula": {
"@id": "https://w3id.org/chemrof/molecular_formula",
"@value": [
"C13H8Cl2N2",
"C15H28O4",
"C6H11Br"
],
"rdfs:label": "Molecular formula",
"provenance": [
{
"prov:wasGeneratedBy": "enrich_references.pubchem_semantic",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:7960",
"CID:160576",
"CID:269018"
],
"prov:wasDerivedFrom": "pubchem.props.Molecular Formula"
},
{
"prov:wasGeneratedBy": "rdkit_post_consensus",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"C(CCCCCCC(=O)O)CCCCCCC(=O)O"
]
}
]
},
"https://w3id.org/chemrof/inchi2d_key_string": {
"@id": "https://w3id.org/chemrof/inchi2d_key_string",
"@value": [
"AQNQQHJNRPDOQV-UHFFFAOYSA-N",
"BTZVDPWKGXMQFW-UHFFFAOYSA-N",
"XAIPJGJDHUBXQY-UHFFFAOYSA-N"
],
"rdfs:label": "InChIKey",
"provenance": [
{
"prov:wasGeneratedBy": "enrich_references.pubchem_semantic",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:7960",
"CID:160576",
"CID:269018"
],
"prov:wasDerivedFrom": "pubchem.props.InChIKey"
},
{
"prov:wasGeneratedBy": "rdkit_post_consensus",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"C(CCCCCCC(=O)O)CCCCCCC(=O)O"
]
}
]
},
"https://w3id.org/chemrof/smiles_string": {
"@id": "https://w3id.org/chemrof/smiles_string",
"@value": [
"C(CCCCCCC(=O)O)CCCCCCC(=O)O",
"C1C2=C(C=C(C=C2)Cl)N=NC3=C1C=CC(=C3)Cl",
"C1CCC(CC1)Br",
"O=C(O)CCCCCCCCCCCCCC(=O)O"
],
"rdfs:label": "SMILES",
"provenance": [
{
"prov:wasGeneratedBy": "enrich_references.pubchem_semantic",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:7960",
"CID:160576",
"CID:269018"
],
"prov:wasDerivedFrom": "pubchem.props.SMILES"
},
{
"prov:wasGeneratedBy": "rdkit_pre_consensus",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"C(CCCCCCC(=O)O)CCCCCCC(=O)O"
]
},
{
"prov:wasGeneratedBy": "rdkit_post_consensus",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"C(CCCCCCC(=O)O)CCCCCCC(=O)O"
]
}
]
},
"https://w3id.org/chemrof/inchi2d_string": {
"@id": "https://w3id.org/chemrof/inchi2d_string",
"@value": [
"InChI=1S/C13H8Cl2N2/c14-10-3-1-8-5-9-2-4-11(15)7-13(9)17-16-12(8)6-10/h1-4,6-7H,5H2",
"InChI=1S/C15H28O4/c16-14(17)12-10-8-6-4-2-1-3-5-7-9-11-13-15(18)19/h1-13H2,(H,16,17)(H,18,19)",
"InChI=1S/C6H11Br/c7-6-4-2-1-3-5-6/h6H,1-5H2"
],
"rdfs:label": "InChI",
"provenance": [
{
"prov:wasGeneratedBy": "enrich_references.pubchem_semantic",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:7960",
"CID:160576",
"CID:269018"
],
"prov:wasDerivedFrom": "pubchem.props.InChI"
},
{
"prov:wasGeneratedBy": "rdkit_post_consensus",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"C(CCCCCCC(=O)O)CCCCCCC(=O)O"
]
}
]
},
"https://w3id.org/chemrof/IUPAC_name": {
"@id": "https://w3id.org/chemrof/IUPAC_name",
"@value": [
"3,8-bis(chloranyl)-11H-benzo[c][1,2]benzodiazepine",
"3,8-dichloro-11H-benzo[c][1,2]benzodiazepine",
"bromanylcyclohexane",
"bromocyclohexane",
"pentadecanedioic acid"
],
"rdfs:label": "IUPAC name",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_semantic",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:7960",
"CID:160576",
"CID:269018"
],
"prov:wasDerivedFrom": "pubchem.identifiers.IUPAC Name"
}
},
"https://w3id.org/chemrof/molecular_mass": {
"@id": "https://w3id.org/chemrof/molecular_mass",
"rdfs:label": "Molecular mass",
"@value": [
"272.385"
],
"provenance": [
{
"prov:wasGeneratedBy": "rdkit_pre_consensus",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"C(CCCCCCC(=O)O)CCCCCCC(=O)O"
]
},
{
"prov:wasGeneratedBy": "rdkit_post_consensus",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"C(CCCCCCC(=O)O)CCCCCCC(=O)O"
]
}
],
"http://qudt.org/schema/qudt/hasUnit": "https://vocab.brightway.one/units/unit/GM-PER-MOL"
},
"https://w3id.org/chemrof/monoisotopic_mass": {
"@id": "https://w3id.org/chemrof/monoisotopic_mass",
"rdfs:label": "Monoisotopic mass",
"@value": [
"272.198759"
],
"provenance": [
{
"prov:wasGeneratedBy": "rdkit_pre_consensus",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"C(CCCCCCC(=O)O)CCCCCCC(=O)O"
]
},
{
"prov:wasGeneratedBy": "rdkit_post_consensus",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"C(CCCCCCC(=O)O)CCCCCCC(=O)O"
]
}
],
"http://qudt.org/schema/qudt/hasUnit": "https://vocab.brightway.one/units/unit/GM-PER-MOL"
}
},
"references": [
{
"@id": "http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J105.002H",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:269018;CAS:108-85-0"
],
"prov:wasDerivedFrom": "pubchem.identifiers[108-85-0]"
}
},
{
"@id": "http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J22.525H",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:160576;CAS:108-85-0"
],
"prov:wasDerivedFrom": "pubchem.identifiers[108-85-0]"
}
},
{
"@id": "http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J5.082B",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:7960;CAS:108-85-0"
],
"prov:wasDerivedFrom": "pubchem.identifiers[108-85-0]"
}
},
{
"@id": "https://chem.echa.europa.eu/100.003.294",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:7960;CAS:108-85-0"
],
"prov:wasDerivedFrom": "pubchem.identifiers[108-85-0]"
}
},
{
"@id": "https://chem.echa.europa.eu/100.204.769",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:160576;CAS:108-85-0"
],
"prov:wasDerivedFrom": "pubchem.identifiers[108-85-0]"
}
},
{
"@id": "https://commonchemistry.cas.org/detail?cas_rn=108-85-0",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.consensus_cas_link",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"108-85-0"
],
"prov:wasDerivedFrom": "cas_numbers"
}
},
{
"@id": "https://commonchemistry.cas.org/detail?cas_rn=1460-18-0",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:160576;CAS:108-85-0"
],
"prov:wasDerivedFrom": "pubchem.identifiers[108-85-0]"
}
},
{
"@id": "https://comptox.epa.gov/dashboard/DTXSID10296477",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:269018;CAS:108-85-0"
],
"prov:wasDerivedFrom": "pubchem.identifiers[108-85-0]"
}
},
{
"@id": "https://comptox.epa.gov/dashboard/DTXSID1044148",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:7960;CAS:108-85-0"
],
"prov:wasDerivedFrom": "pubchem.identifiers[108-85-0]"
}
},
{
"@id": "https://comptox.epa.gov/dashboard/DTXSID1074337",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:160576;CAS:108-85-0"
],
"prov:wasDerivedFrom": "pubchem.identifiers[108-85-0]"
}
},
{
"@id": "https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=109541",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:269018;CAS:108-85-0"
],
"prov:wasDerivedFrom": "pubchem.identifiers[108-85-0]"
}
},
{
"@id": "https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=11207",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:7960;CAS:108-85-0"
],
"prov:wasDerivedFrom": "pubchem.identifiers[108-85-0]"
}
},
{
"@id": "https://en.wikipedia.org/wiki/Bromocyclohexane",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:7960;CAS:108-85-0"
],
"prov:wasDerivedFrom": "pubchem.identifiers[108-85-0]"
}
},
{
"@id": "https://gsrs.ncats.nih.gov/ginas/app/beta/substances/0C9LD26ZA0",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:160576;CAS:108-85-0"
],
"prov:wasDerivedFrom": "pubchem.identifiers[108-85-0]"
}
},
{
"@id": "https://gsrs.ncats.nih.gov/ginas/app/beta/substances/YA0UMS4RNY",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:7960;CAS:108-85-0"
],
"prov:wasDerivedFrom": "pubchem.identifiers[108-85-0]"
}
},
{
"@id": "https://lipidmaps.org/databases/lmsd/LMFA01170021",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:160576;CAS:108-85-0"
],
"prov:wasDerivedFrom": "pubchem.identifiers[108-85-0]"
}
},
{
"@id": "https://pubchem.ncbi.nlm.nih.gov/compound/160576",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_compound",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:160576;CAS:108-85-0"
],
"prov:wasDerivedFrom": "pubchem.by_cas[108-85-0]"
}
},
{
"@id": "https://pubchem.ncbi.nlm.nih.gov/compound/269018",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_compound",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:269018;CAS:108-85-0"
],
"prov:wasDerivedFrom": "pubchem.by_cas[108-85-0]"
}
},
{
"@id": "https://pubchem.ncbi.nlm.nih.gov/compound/7960",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_compound",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:7960;CAS:108-85-0"
],
"prov:wasDerivedFrom": "pubchem.by_cas[108-85-0]"
}
},
{
"@id": "https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:165387",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:160576;CAS:108-85-0"
],
"prov:wasDerivedFrom": "pubchem.identifiers[108-85-0]"
}
},
{
"@id": "https://www.metabolomicsworkbench.org/data/StructureData.php?RegNo=1945",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:160576;CAS:108-85-0"
],
"prov:wasDerivedFrom": "pubchem.identifiers[108-85-0]"
}
},
{
"@id": "https://www.wikidata.org/wiki/Q72499692",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:160576;CAS:108-85-0"
],
"prov:wasDerivedFrom": "pubchem.identifiers[108-85-0]"
}
},
{
"@id": "https://www.wikidata.org/wiki/Q82037103",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:269018;CAS:108-85-0"
],
"prov:wasDerivedFrom": "pubchem.identifiers[108-85-0]"
}
},
{
"@id": "https://www.wikidata.org/wiki/Q82427",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:7960;CAS:108-85-0"
],
"prov:wasDerivedFrom": "pubchem.identifiers[108-85-0]"
}
}
],
"created_from": {
"resolver": "hybrid_name_cas_v1",
"seed_uuid": "2622b5fe-7c0b-4fa1-8dd4-60bb327a9a16",
"seed_source": "EF 3.1"
},
"classifications": {
"http://semanticscience.org/resource/CHEMINF_000446": {
"@value": [
"108-85-0"
],
"rdfs:seeAlso": [
"https://commonchemistry.cas.org/detail?cas_rn=108-85-0"
],
"skos:exactMatch": [
{
"@id": "https://commonchemistry.cas.org/detail?cas_rn=108-85-0"
}
],
"provenance": {
"prov:wasGeneratedBy": "hybrid_name_cas_v1",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"EF 3.1"
],
"prov:wasDerivedFrom": "cas_numbers"
}
},
"http://semanticscience.org/resource/CHEMINF_000447": {
"@value": [
"203-622-2"
],
"rdfs:seeAlso": [
"https://echa.europa.eu/search-for-chemicals?query=203-622-2"
],
"provenance": {
"prov:wasGeneratedBy": "hybrid_name_cas_v1",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"EF 3.1"
],
"prov:wasDerivedFrom": "ec_numbers"
}
}
},
"origin_qualifier": null,
"parent_flow_object_id": null
}