← Back to consensus flow objects
2-methylhexane
| Flow Object ID | fo-f04effc6abe03c20 | |||||||||
|---|---|---|---|---|---|---|---|---|---|---|
| Type | Consensus | |||||||||
| prefLabel |
|
|||||||||
| Alt Labels |
|
|||||||||
| CAS Numbers | 591-76-4 | |||||||||
| EC Numbers | 209-730-6 | |||||||||
| Changes Applied | 24 |
Properties
| Predicate | Value |
|---|---|
| InChIKey |
GXDHCNNESPLIKD-UHFFFAOYSA-N
|
| InChI |
InChI=1S/C7H16/c1-4-5-6-7(2)3/h7H,4-6H2,1-3H3
|
| IUPAC name |
2-methylhexane
|
| Molecular formula |
C7H16
|
| SMILES |
CCCCC(C)C
|
References
- http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J43.564C
- https://chem.echa.europa.eu/100.008.847
- https://chem.echa.europa.eu/100.045.994
- https://chemicalsafety.ilo.org/dyn/icsc/showcard.display?p_card_id=0658
- https://commonchemistry.cas.org/detail?cas_rn=591-76-4
- https://comptox.epa.gov/dashboard/DTXSID5052256
- https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=24840
- https://en.wikipedia.org/wiki/2-Methylhexane
- https://gsrs.ncats.nih.gov/ginas/app/beta/substances/YI4679P2SP
- https://hmdb.ca/metabolites/HMDB0245230
- https://pubchem.ncbi.nlm.nih.gov/compound/11582
- https://pubchem.ncbi.nlm.nih.gov/erg/#1206
- https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:230545
- https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL1797267
- https://www.wikidata.org/wiki/Q183300
Linked Elementary Flows
| UUID | Source | Unit | Context | LCIA Factors | Consensus Changes |
|---|---|---|---|---|---|
1729c886… |
EF 3.1 | kg | Environmental → Air → Aircraft cruise height | 1 | 2 |
fe0acd60… |
EF 3.1 | kg | Environmental → Air → Ground level → Rural (<1000 people/square mile) | 1 | 2 |
fe0acd60… |
EF 3.1 | kg | Environmental → Air → Ground level → Urban (>1000 people/square mile) | 1 | 2 |
fe0acd60… |
EF 3.1 | kg | Environmental → Air → High stack, >150 meters | 1 | 2 |
fe0acd60… |
EF 3.1 | kg | Environmental → Air → Unknown | 1 | 2 |
1729c884… |
EF 3.1 | kg | Environmental → Ground → Agricultural | 0 | 2 |
1729c887… |
EF 3.1 | kg | Environmental → Ground → Unknown | 0 | 2 |
1729c888… |
EF 3.1 | kg | Environmental → Water → Ocean | 0 | 2 |
1729c885… |
EF 3.1 | kg | Environmental → Water → Surface water | 0 | 2 |
1729c88c… |
EF 3.1 | kg | Environmental → Water → Unknown | 0 | 2 |
▶
Changes Applied
| Elementary Flow | Field | Old Value | New Value | Comment |
|---|---|---|---|---|
1729c884… |
altLabel |
— |
[{"@value":"Hexane, 2-methyl-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:591-76-4","https://commonchemistry.cas.org/detail?cas_rn=591-76-4"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"NSC 24840","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:591-76-4","https://commonchemistry.cas.org/detail?cas_rn=591-76-4"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] |
group_key=2-methylhexane||dimension=Environmental > media=Ground > geography=Agricultural; cas=591-76-4; added Common Chemistry CAS names as altLabel: Hexane, 2-methyl-, NSC 24840; object_uuid=fo-f04effc6abe03c20 |
1729c884… |
cas_match_labels |
— |
{"591-76-4":"exactMatch"} |
group_key=2-methylhexane||dimension=Environmental > media=Ground > geography=Agricultural; group_sources=['ec_inventory']; cas_sources={'591-76-4': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-f04effc6abe03c20: {'591-76-4': 'exactMatch'} |
1729c885… |
altLabel |
— |
[{"@value":"Hexane, 2-methyl-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:591-76-4","https://commonchemistry.cas.org/detail?cas_rn=591-76-4"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"NSC 24840","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:591-76-4","https://commonchemistry.cas.org/detail?cas_rn=591-76-4"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] |
group_key=2-methylhexane||dimension=Environmental > media=Ground > geography=Agricultural; cas=591-76-4; added Common Chemistry CAS names as altLabel: Hexane, 2-methyl-, NSC 24840; object_uuid=fo-f04effc6abe03c20 |
1729c885… |
cas_match_labels |
— |
{"591-76-4":"exactMatch"} |
group_key=2-methylhexane||dimension=Environmental > media=Ground > geography=Agricultural; group_sources=['ec_inventory']; cas_sources={'591-76-4': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-f04effc6abe03c20: {'591-76-4': 'exactMatch'} |
1729c886… |
altLabel |
— |
[{"@value":"Hexane, 2-methyl-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:591-76-4","https://commonchemistry.cas.org/detail?cas_rn=591-76-4"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"NSC 24840","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:591-76-4","https://commonchemistry.cas.org/detail?cas_rn=591-76-4"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] |
group_key=2-methylhexane||dimension=Environmental > media=Ground > geography=Agricultural; cas=591-76-4; added Common Chemistry CAS names as altLabel: Hexane, 2-methyl-, NSC 24840; object_uuid=fo-f04effc6abe03c20 |
1729c886… |
cas_match_labels |
— |
{"591-76-4":"exactMatch"} |
group_key=2-methylhexane||dimension=Environmental > media=Ground > geography=Agricultural; group_sources=['ec_inventory']; cas_sources={'591-76-4': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-f04effc6abe03c20: {'591-76-4': 'exactMatch'} |
1729c887… |
altLabel |
— |
[{"@value":"Hexane, 2-methyl-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:591-76-4","https://commonchemistry.cas.org/detail?cas_rn=591-76-4"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"NSC 24840","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:591-76-4","https://commonchemistry.cas.org/detail?cas_rn=591-76-4"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] |
group_key=2-methylhexane||dimension=Environmental > media=Ground > geography=Agricultural; cas=591-76-4; added Common Chemistry CAS names as altLabel: Hexane, 2-methyl-, NSC 24840; object_uuid=fo-f04effc6abe03c20 |
1729c887… |
cas_match_labels |
— |
{"591-76-4":"exactMatch"} |
group_key=2-methylhexane||dimension=Environmental > media=Ground > geography=Agricultural; group_sources=['ec_inventory']; cas_sources={'591-76-4': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-f04effc6abe03c20: {'591-76-4': 'exactMatch'} |
1729c888… |
altLabel |
— |
[{"@value":"Hexane, 2-methyl-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:591-76-4","https://commonchemistry.cas.org/detail?cas_rn=591-76-4"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"NSC 24840","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:591-76-4","https://commonchemistry.cas.org/detail?cas_rn=591-76-4"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] |
group_key=2-methylhexane||dimension=Environmental > media=Ground > geography=Agricultural; cas=591-76-4; added Common Chemistry CAS names as altLabel: Hexane, 2-methyl-, NSC 24840; object_uuid=fo-f04effc6abe03c20 |
1729c888… |
cas_match_labels |
— |
{"591-76-4":"exactMatch"} |
group_key=2-methylhexane||dimension=Environmental > media=Ground > geography=Agricultural; group_sources=['ec_inventory']; cas_sources={'591-76-4': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-f04effc6abe03c20: {'591-76-4': 'exactMatch'} |
1729c88b… |
altLabel |
— |
[{"@value":"Hexane, 2-methyl-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:591-76-4","https://commonchemistry.cas.org/detail?cas_rn=591-76-4"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"NSC 24840","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:591-76-4","https://commonchemistry.cas.org/detail?cas_rn=591-76-4"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] |
group_key=2-methylhexane||dimension=Environmental > media=Ground > geography=Agricultural; cas=591-76-4; added Common Chemistry CAS names as altLabel: Hexane, 2-methyl-, NSC 24840; object_uuid=fo-f04effc6abe03c20 |
1729c88b… |
cas_match_labels |
— |
{"591-76-4":"exactMatch"} |
group_key=2-methylhexane||dimension=Environmental > media=Ground > geography=Agricultural; group_sources=['ec_inventory']; cas_sources={'591-76-4': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-f04effc6abe03c20: {'591-76-4': 'exactMatch'} |
1729c88c… |
altLabel |
— |
[{"@value":"Hexane, 2-methyl-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:591-76-4","https://commonchemistry.cas.org/detail?cas_rn=591-76-4"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"NSC 24840","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:591-76-4","https://commonchemistry.cas.org/detail?cas_rn=591-76-4"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] |
group_key=2-methylhexane||dimension=Environmental > media=Ground > geography=Agricultural; cas=591-76-4; added Common Chemistry CAS names as altLabel: Hexane, 2-methyl-, NSC 24840; object_uuid=fo-f04effc6abe03c20 |
1729c88c… |
cas_match_labels |
— |
{"591-76-4":"exactMatch"} |
group_key=2-methylhexane||dimension=Environmental > media=Ground > geography=Agricultural; group_sources=['ec_inventory']; cas_sources={'591-76-4': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-f04effc6abe03c20: {'591-76-4': 'exactMatch'} |
1729c88d… |
altLabel |
— |
[{"@value":"Hexane, 2-methyl-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:591-76-4","https://commonchemistry.cas.org/detail?cas_rn=591-76-4"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"NSC 24840","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:591-76-4","https://commonchemistry.cas.org/detail?cas_rn=591-76-4"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] |
group_key=2-methylhexane||dimension=Environmental > media=Ground > geography=Agricultural; cas=591-76-4; added Common Chemistry CAS names as altLabel: Hexane, 2-methyl-, NSC 24840; object_uuid=fo-f04effc6abe03c20 |
1729c88d… |
cas_match_labels |
— |
{"591-76-4":"exactMatch"} |
group_key=2-methylhexane||dimension=Environmental > media=Ground > geography=Agricultural; group_sources=['ec_inventory']; cas_sources={'591-76-4': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-f04effc6abe03c20: {'591-76-4': 'exactMatch'} |
fe0acd60… |
altLabel |
— |
[{"@value":"Hexane, 2-methyl-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:591-76-4","https://commonchemistry.cas.org/detail?cas_rn=591-76-4"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"NSC 24840","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:591-76-4","https://commonchemistry.cas.org/detail?cas_rn=591-76-4"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] |
group_key=2-methylhexane||dimension=Environmental > media=Ground > geography=Agricultural; cas=591-76-4; added Common Chemistry CAS names as altLabel: Hexane, 2-methyl-, NSC 24840; object_uuid=fo-f04effc6abe03c20 |
fe0acd60… |
cas_match_labels |
— |
{"591-76-4":"exactMatch"} |
group_key=2-methylhexane||dimension=Environmental > media=Ground > geography=Agricultural; group_sources=['ec_inventory']; cas_sources={'591-76-4': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-f04effc6abe03c20: {'591-76-4': 'exactMatch'} |
fe0acd60… |
altLabel |
— |
[{"@value":"Hexane, 2-methyl-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:591-76-4","https://commonchemistry.cas.org/detail?cas_rn=591-76-4"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"NSC 24840","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:591-76-4","https://commonchemistry.cas.org/detail?cas_rn=591-76-4"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] |
group_key=2-methylhexane||dimension=Environmental > media=Ground > geography=Agricultural; cas=591-76-4; added Common Chemistry CAS names as altLabel: Hexane, 2-methyl-, NSC 24840; object_uuid=fo-f04effc6abe03c20 |
fe0acd60… |
cas_match_labels |
— |
{"591-76-4":"exactMatch"} |
group_key=2-methylhexane||dimension=Environmental > media=Ground > geography=Agricultural; group_sources=['ec_inventory']; cas_sources={'591-76-4': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-f04effc6abe03c20: {'591-76-4': 'exactMatch'} |
fe0acd60… |
altLabel |
— |
[{"@value":"Hexane, 2-methyl-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:591-76-4","https://commonchemistry.cas.org/detail?cas_rn=591-76-4"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"NSC 24840","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:591-76-4","https://commonchemistry.cas.org/detail?cas_rn=591-76-4"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] |
group_key=2-methylhexane||dimension=Environmental > media=Ground > geography=Agricultural; cas=591-76-4; added Common Chemistry CAS names as altLabel: Hexane, 2-methyl-, NSC 24840; object_uuid=fo-f04effc6abe03c20 |
fe0acd60… |
cas_match_labels |
— |
{"591-76-4":"exactMatch"} |
group_key=2-methylhexane||dimension=Environmental > media=Ground > geography=Agricultural; group_sources=['ec_inventory']; cas_sources={'591-76-4': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-f04effc6abe03c20: {'591-76-4': 'exactMatch'} |
fe0acd60… |
altLabel |
— |
[{"@value":"Hexane, 2-methyl-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:591-76-4","https://commonchemistry.cas.org/detail?cas_rn=591-76-4"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"NSC 24840","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:591-76-4","https://commonchemistry.cas.org/detail?cas_rn=591-76-4"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] |
group_key=2-methylhexane||dimension=Environmental > media=Ground > geography=Agricultural; cas=591-76-4; added Common Chemistry CAS names as altLabel: Hexane, 2-methyl-, NSC 24840; object_uuid=fo-f04effc6abe03c20 |
fe0acd60… |
cas_match_labels |
— |
{"591-76-4":"exactMatch"} |
group_key=2-methylhexane||dimension=Environmental > media=Ground > geography=Agricultural; group_sources=['ec_inventory']; cas_sources={'591-76-4': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-f04effc6abe03c20: {'591-76-4': 'exactMatch'} |
Flow Object JSON
{
"flow_object_id": "fo-f04effc6abe03c20",
"prefLabel": [
{
"@value": "2-methylhexane",
"@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": "Hexane, 2-methyl-",
"@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 24840",
"@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": [
"C7H16"
],
"rdfs:label": "Molecular formula",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_semantic",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:11582"
],
"prov:wasDerivedFrom": "pubchem.props.Molecular Formula"
}
},
"https://w3id.org/chemrof/inchi2d_key_string": {
"@id": "https://w3id.org/chemrof/inchi2d_key_string",
"@value": [
"GXDHCNNESPLIKD-UHFFFAOYSA-N"
],
"rdfs:label": "InChIKey",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_semantic",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:11582"
],
"prov:wasDerivedFrom": "pubchem.props.InChIKey"
}
},
"https://w3id.org/chemrof/smiles_string": {
"@id": "https://w3id.org/chemrof/smiles_string",
"@value": [
"CCCCC(C)C"
],
"rdfs:label": "SMILES",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_semantic",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:11582"
],
"prov:wasDerivedFrom": "pubchem.props.SMILES"
}
},
"https://w3id.org/chemrof/inchi2d_string": {
"@id": "https://w3id.org/chemrof/inchi2d_string",
"@value": [
"InChI=1S/C7H16/c1-4-5-6-7(2)3/h7H,4-6H2,1-3H3"
],
"rdfs:label": "InChI",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_semantic",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:11582"
],
"prov:wasDerivedFrom": "pubchem.props.InChI"
}
},
"https://w3id.org/chemrof/IUPAC_name": {
"@id": "https://w3id.org/chemrof/IUPAC_name",
"@value": [
"2-methylhexane"
],
"rdfs:label": "IUPAC name",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_semantic",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:11582"
],
"prov:wasDerivedFrom": "pubchem.identifiers.IUPAC Name"
}
}
},
"references": [
{
"@id": "http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J43.564C",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:11582;CAS:591-76-4"
],
"prov:wasDerivedFrom": "pubchem.identifiers[591-76-4]"
}
},
{
"@id": "https://chem.echa.europa.eu/100.008.847",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:11582;CAS:591-76-4"
],
"prov:wasDerivedFrom": "pubchem.identifiers[591-76-4]"
}
},
{
"@id": "https://chem.echa.europa.eu/100.045.994",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:11582;CAS:591-76-4"
],
"prov:wasDerivedFrom": "pubchem.identifiers[591-76-4]"
}
},
{
"@id": "https://chemicalsafety.ilo.org/dyn/icsc/showcard.display?p_card_id=0658",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:11582;CAS:591-76-4"
],
"prov:wasDerivedFrom": "pubchem.identifiers[591-76-4]"
}
},
{
"@id": "https://commonchemistry.cas.org/detail?cas_rn=591-76-4",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:11582;CAS:591-76-4"
],
"prov:wasDerivedFrom": "pubchem.identifiers[591-76-4]"
}
},
{
"@id": "https://comptox.epa.gov/dashboard/DTXSID5052256",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:11582;CAS:591-76-4"
],
"prov:wasDerivedFrom": "pubchem.identifiers[591-76-4]"
}
},
{
"@id": "https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=24840",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:11582;CAS:591-76-4"
],
"prov:wasDerivedFrom": "pubchem.identifiers[591-76-4]"
}
},
{
"@id": "https://en.wikipedia.org/wiki/2-Methylhexane",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:11582;CAS:591-76-4"
],
"prov:wasDerivedFrom": "pubchem.identifiers[591-76-4]"
}
},
{
"@id": "https://gsrs.ncats.nih.gov/ginas/app/beta/substances/YI4679P2SP",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:11582;CAS:591-76-4"
],
"prov:wasDerivedFrom": "pubchem.identifiers[591-76-4]"
}
},
{
"@id": "https://hmdb.ca/metabolites/HMDB0245230",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:11582;CAS:591-76-4"
],
"prov:wasDerivedFrom": "pubchem.identifiers[591-76-4]"
}
},
{
"@id": "https://pubchem.ncbi.nlm.nih.gov/compound/11582",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_compound",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:11582;CAS:591-76-4"
],
"prov:wasDerivedFrom": "pubchem.by_cas[591-76-4]"
}
},
{
"@id": "https://pubchem.ncbi.nlm.nih.gov/erg/#1206",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:11582;CAS:591-76-4"
],
"prov:wasDerivedFrom": "pubchem.identifiers[591-76-4]"
}
},
{
"@id": "https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:230545",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:11582;CAS:591-76-4"
],
"prov:wasDerivedFrom": "pubchem.identifiers[591-76-4]"
}
},
{
"@id": "https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL1797267",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:11582;CAS:591-76-4"
],
"prov:wasDerivedFrom": "pubchem.identifiers[591-76-4]"
}
},
{
"@id": "https://www.wikidata.org/wiki/Q183300",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:11582;CAS:591-76-4"
],
"prov:wasDerivedFrom": "pubchem.identifiers[591-76-4]"
}
}
],
"created_from": {
"resolver": "hybrid_name_cas_v1",
"seed_uuid": "1729c884-6556-11dd-ad8b-0800200c9a66",
"seed_source": "EF 3.1"
},
"classifications": {
"http://semanticscience.org/resource/CHEMINF_000446": {
"@value": [
"591-76-4"
],
"rdfs:seeAlso": [
"https://commonchemistry.cas.org/detail?cas_rn=591-76-4"
],
"skos:exactMatch": [
{
"@id": "https://commonchemistry.cas.org/detail?cas_rn=591-76-4"
}
],
"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": [
"209-730-6"
],
"rdfs:seeAlso": [
"https://echa.europa.eu/search-for-chemicals?query=209-730-6"
],
"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
}