← Back to consensus flow objects
trans,trans-2,4-Hexadiene
| Flow Object ID | fo-58a245f5d3336a8b | |||||||||
|---|---|---|---|---|---|---|---|---|---|---|
| Type | Consensus | |||||||||
| prefLabel |
|
|||||||||
| Alt Labels |
|
|||||||||
| CAS Numbers |
68514-38-5
|
|||||||||
| EC Numbers |
271-040-6
|
|||||||||
| Changes Applied | 26 |
Provenance
| Field | Value |
|---|---|
| Resolver | hybrid_name_cas_v1 |
| Seed Source | EF 3.1 |
| Seed Flow | 2926a99e-7da2-41f1-bff8-c3011e0a9d77 |
Properties
| Predicate | Value |
|---|---|
| InChIKey |
APPOKADJQUIAHP-GGWOSOGESA-N
|
| InChI |
InChI=1S/C6H10/c1-3-5-6-4-2/h3-6H,1-2H3/b5-3+,6-4+
|
| IUPAC name |
(2E,4E)-hexa-2,4-diene
|
| Molecular formula |
C6H10
|
| Molecular mass |
82.146
|
| Monoisotopic mass |
82.07825
|
| SMILES |
C/C=C/C=C/C, CC=CC=CC
|
References
- http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J147.953I
- http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J94.862D
- https://chem.echa.europa.eu/100.023.619
- https://commonchemistry.cas.org/detail?cas_rn=5194-51-4
- https://commonchemistry.cas.org/detail?cas_rn=68514-38-5
- https://comptox.epa.gov/dashboard/DTXSID10859501
- https://gsrs.ncats.nih.gov/ginas/app/beta/substances/8NFN12O8UQ
- https://pubchem.ncbi.nlm.nih.gov/compound/638071
- https://www.wikidata.org/wiki/Q27270785
Linked Elementary Flows
| UUID | Source | Unit | Context | LCIA Factors | Consensus Changes |
|---|---|---|---|---|---|
5d949f0c… |
EF 3.1 | kg | Environmental → Air → Aircraft cruise height | 4 | 2 |
2926a99e… |
EF 3.1 | kg | Environmental → Air → Ground level → Rural (<1000 people/square mile) | 0 | 2 |
c88009f0… |
EF 3.1 | kg | Environmental → Air → Ground level → Urban (>1000 people/square mile) | 4 | 2 |
baf5f154… |
EF 3.1 | kg | Environmental → Air → High stack, >150 meters | 4 | 2 |
7539dd6e… |
EF 3.1 | kg | Environmental → Air → Unknown | 4 | 2 |
f246d701… |
EF 3.1 | kg | Environmental → Air → Unknown | 4 | 2 |
47360ca0… |
EF 3.1 | kg | Environmental → Ground → Agricultural | 4 | 2 |
a38e1d3f… |
EF 3.1 | kg | Environmental → Ground → Unknown | 4 | 2 |
baae2b77… |
EF 3.1 | kg | Environmental → Water → Ocean | 4 | 2 |
ca490720… |
EF 3.1 | kg | Environmental → Water → Surface water | 4 | 2 |
beaaa084… |
EF 3.1 | kg | Environmental → Water → Unknown | 4 | 2 |
▶
Changes Applied
| Elementary Flow | Field | Old Value | New Value | Comment |
|---|---|---|---|---|
2926a99e… |
altLabel |
— |
[{"@value":"Hydrocarbons, C<sub>4-10</sub>-unsatd.","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:68514-38-5","https://commonchemistry.cas.org/detail?cas_rn=68514-38-5"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] |
group_key=hydrocarbons,c4-10-unsaturated||dimension=Environmental > media=Air > strata=Ground level > population_density=Rural (<1000 people/square mile); cas=68514-38-5; added Common Chemistry CAS names as altLabel: Hydrocarbons, C<sub>4-10</sub>-unsatd.; object_uuid=fo-58a245f5d3336a8b |
2926a99e… |
cas_match_labels |
— |
{"68514-38-5":"exactMatch"} |
group_key=hydrocarbons,c4-10-unsaturated||dimension=Environmental > media=Air > strata=Ground level > population_density=Rural (<1000 people/square mile); group_sources=['ec_inventory']; cas_sources={'68514-38-5': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-58a245f5d3336a8b: {'68514-38-5': 'exactMatch'} |
47360ca0… |
altLabel |
— |
[{"@value":"Hydrocarbons, C<sub>4-10</sub>-unsatd.","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:68514-38-5","https://commonchemistry.cas.org/detail?cas_rn=68514-38-5"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] |
group_key=hydrocarbons,c4-10-unsaturated||dimension=Environmental > media=Air > strata=Ground level > population_density=Rural (<1000 people/square mile); cas=68514-38-5; added Common Chemistry CAS names as altLabel: Hydrocarbons, C<sub>4-10</sub>-unsatd.; object_uuid=fo-58a245f5d3336a8b |
47360ca0… |
cas_match_labels |
— |
{"68514-38-5":"exactMatch"} |
group_key=hydrocarbons,c4-10-unsaturated||dimension=Environmental > media=Air > strata=Ground level > population_density=Rural (<1000 people/square mile); group_sources=['ec_inventory']; cas_sources={'68514-38-5': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-58a245f5d3336a8b: {'68514-38-5': 'exactMatch'} |
5d949f0c… |
altLabel |
— |
[{"@value":"Hydrocarbons, C<sub>4-10</sub>-unsatd.","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:68514-38-5","https://commonchemistry.cas.org/detail?cas_rn=68514-38-5"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] |
group_key=hydrocarbons,c4-10-unsaturated||dimension=Environmental > media=Air > strata=Ground level > population_density=Rural (<1000 people/square mile); cas=68514-38-5; added Common Chemistry CAS names as altLabel: Hydrocarbons, C<sub>4-10</sub>-unsatd.; object_uuid=fo-58a245f5d3336a8b |
5d949f0c… |
cas_match_labels |
— |
{"68514-38-5":"exactMatch"} |
group_key=hydrocarbons,c4-10-unsaturated||dimension=Environmental > media=Air > strata=Ground level > population_density=Rural (<1000 people/square mile); group_sources=['ec_inventory']; cas_sources={'68514-38-5': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-58a245f5d3336a8b: {'68514-38-5': 'exactMatch'} |
6b76da65… |
altLabel |
— |
[{"@value":"Hydrocarbons, C<sub>4-10</sub>-unsatd.","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:68514-38-5","https://commonchemistry.cas.org/detail?cas_rn=68514-38-5"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] |
group_key=hydrocarbons,c4-10-unsaturated||dimension=Environmental > media=Air > strata=Ground level > population_density=Rural (<1000 people/square mile); cas=68514-38-5; added Common Chemistry CAS names as altLabel: Hydrocarbons, C<sub>4-10</sub>-unsatd.; object_uuid=fo-58a245f5d3336a8b |
6b76da65… |
cas_match_labels |
— |
{"68514-38-5":"exactMatch"} |
group_key=hydrocarbons,c4-10-unsaturated||dimension=Environmental > media=Air > strata=Ground level > population_density=Rural (<1000 people/square mile); group_sources=['ec_inventory']; cas_sources={'68514-38-5': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-58a245f5d3336a8b: {'68514-38-5': 'exactMatch'} |
7539dd6e… |
altLabel |
— |
[{"@value":"Hydrocarbons, C<sub>4-10</sub>-unsatd.","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:68514-38-5","https://commonchemistry.cas.org/detail?cas_rn=68514-38-5"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] |
group_key=hydrocarbons,c4-10-unsaturated||dimension=Environmental > media=Air > strata=Ground level > population_density=Rural (<1000 people/square mile); cas=68514-38-5; added Common Chemistry CAS names as altLabel: Hydrocarbons, C<sub>4-10</sub>-unsatd.; object_uuid=fo-58a245f5d3336a8b |
7539dd6e… |
cas_match_labels |
— |
{"68514-38-5":"exactMatch"} |
group_key=hydrocarbons,c4-10-unsaturated||dimension=Environmental > media=Air > strata=Ground level > population_density=Rural (<1000 people/square mile); group_sources=['ec_inventory']; cas_sources={'68514-38-5': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-58a245f5d3336a8b: {'68514-38-5': 'exactMatch'} |
a38e1d3f… |
altLabel |
— |
[{"@value":"Hydrocarbons, C<sub>4-10</sub>-unsatd.","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:68514-38-5","https://commonchemistry.cas.org/detail?cas_rn=68514-38-5"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] |
group_key=hydrocarbons,c4-10-unsaturated||dimension=Environmental > media=Air > strata=Ground level > population_density=Rural (<1000 people/square mile); cas=68514-38-5; added Common Chemistry CAS names as altLabel: Hydrocarbons, C<sub>4-10</sub>-unsatd.; object_uuid=fo-58a245f5d3336a8b |
a38e1d3f… |
cas_match_labels |
— |
{"68514-38-5":"exactMatch"} |
group_key=hydrocarbons,c4-10-unsaturated||dimension=Environmental > media=Air > strata=Ground level > population_density=Rural (<1000 people/square mile); group_sources=['ec_inventory']; cas_sources={'68514-38-5': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-58a245f5d3336a8b: {'68514-38-5': 'exactMatch'} |
baae2b77… |
altLabel |
— |
[{"@value":"Hydrocarbons, C<sub>4-10</sub>-unsatd.","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:68514-38-5","https://commonchemistry.cas.org/detail?cas_rn=68514-38-5"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] |
group_key=hydrocarbons,c4-10-unsaturated||dimension=Environmental > media=Air > strata=Ground level > population_density=Rural (<1000 people/square mile); cas=68514-38-5; added Common Chemistry CAS names as altLabel: Hydrocarbons, C<sub>4-10</sub>-unsatd.; object_uuid=fo-58a245f5d3336a8b |
baae2b77… |
cas_match_labels |
— |
{"68514-38-5":"exactMatch"} |
group_key=hydrocarbons,c4-10-unsaturated||dimension=Environmental > media=Air > strata=Ground level > population_density=Rural (<1000 people/square mile); group_sources=['ec_inventory']; cas_sources={'68514-38-5': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-58a245f5d3336a8b: {'68514-38-5': 'exactMatch'} |
baf5f154… |
altLabel |
— |
[{"@value":"Hydrocarbons, C<sub>4-10</sub>-unsatd.","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:68514-38-5","https://commonchemistry.cas.org/detail?cas_rn=68514-38-5"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] |
group_key=hydrocarbons,c4-10-unsaturated||dimension=Environmental > media=Air > strata=Ground level > population_density=Rural (<1000 people/square mile); cas=68514-38-5; added Common Chemistry CAS names as altLabel: Hydrocarbons, C<sub>4-10</sub>-unsatd.; object_uuid=fo-58a245f5d3336a8b |
baf5f154… |
cas_match_labels |
— |
{"68514-38-5":"exactMatch"} |
group_key=hydrocarbons,c4-10-unsaturated||dimension=Environmental > media=Air > strata=Ground level > population_density=Rural (<1000 people/square mile); group_sources=['ec_inventory']; cas_sources={'68514-38-5': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-58a245f5d3336a8b: {'68514-38-5': 'exactMatch'} |
beaaa084… |
altLabel |
— |
[{"@value":"Hydrocarbons, C<sub>4-10</sub>-unsatd.","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:68514-38-5","https://commonchemistry.cas.org/detail?cas_rn=68514-38-5"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] |
group_key=hydrocarbons,c4-10-unsaturated||dimension=Environmental > media=Air > strata=Ground level > population_density=Rural (<1000 people/square mile); cas=68514-38-5; added Common Chemistry CAS names as altLabel: Hydrocarbons, C<sub>4-10</sub>-unsatd.; object_uuid=fo-58a245f5d3336a8b |
beaaa084… |
cas_match_labels |
— |
{"68514-38-5":"exactMatch"} |
group_key=hydrocarbons,c4-10-unsaturated||dimension=Environmental > media=Air > strata=Ground level > population_density=Rural (<1000 people/square mile); group_sources=['ec_inventory']; cas_sources={'68514-38-5': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-58a245f5d3336a8b: {'68514-38-5': 'exactMatch'} |
c88009f0… |
altLabel |
— |
[{"@value":"Hydrocarbons, C<sub>4-10</sub>-unsatd.","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:68514-38-5","https://commonchemistry.cas.org/detail?cas_rn=68514-38-5"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] |
group_key=hydrocarbons,c4-10-unsaturated||dimension=Environmental > media=Air > strata=Ground level > population_density=Rural (<1000 people/square mile); cas=68514-38-5; added Common Chemistry CAS names as altLabel: Hydrocarbons, C<sub>4-10</sub>-unsatd.; object_uuid=fo-58a245f5d3336a8b |
c88009f0… |
cas_match_labels |
— |
{"68514-38-5":"exactMatch"} |
group_key=hydrocarbons,c4-10-unsaturated||dimension=Environmental > media=Air > strata=Ground level > population_density=Rural (<1000 people/square mile); group_sources=['ec_inventory']; cas_sources={'68514-38-5': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-58a245f5d3336a8b: {'68514-38-5': 'exactMatch'} |
ca490720… |
altLabel |
— |
[{"@value":"Hydrocarbons, C<sub>4-10</sub>-unsatd.","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:68514-38-5","https://commonchemistry.cas.org/detail?cas_rn=68514-38-5"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] |
group_key=hydrocarbons,c4-10-unsaturated||dimension=Environmental > media=Air > strata=Ground level > population_density=Rural (<1000 people/square mile); cas=68514-38-5; added Common Chemistry CAS names as altLabel: Hydrocarbons, C<sub>4-10</sub>-unsatd.; object_uuid=fo-58a245f5d3336a8b |
ca490720… |
cas_match_labels |
— |
{"68514-38-5":"exactMatch"} |
group_key=hydrocarbons,c4-10-unsaturated||dimension=Environmental > media=Air > strata=Ground level > population_density=Rural (<1000 people/square mile); group_sources=['ec_inventory']; cas_sources={'68514-38-5': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-58a245f5d3336a8b: {'68514-38-5': 'exactMatch'} |
d3f80b36… |
altLabel |
— |
[{"@value":"Hydrocarbons, C<sub>4-10</sub>-unsatd.","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:68514-38-5","https://commonchemistry.cas.org/detail?cas_rn=68514-38-5"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] |
group_key=hydrocarbons,c4-10-unsaturated||dimension=Environmental > media=Air > strata=Ground level > population_density=Rural (<1000 people/square mile); cas=68514-38-5; added Common Chemistry CAS names as altLabel: Hydrocarbons, C<sub>4-10</sub>-unsatd.; object_uuid=fo-58a245f5d3336a8b |
d3f80b36… |
cas_match_labels |
— |
{"68514-38-5":"exactMatch"} |
group_key=hydrocarbons,c4-10-unsaturated||dimension=Environmental > media=Air > strata=Ground level > population_density=Rural (<1000 people/square mile); group_sources=['ec_inventory']; cas_sources={'68514-38-5': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-58a245f5d3336a8b: {'68514-38-5': 'exactMatch'} |
f246d701… |
altLabel |
— |
[{"@value":"Hydrocarbons, C<sub>4-10</sub>-unsatd.","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:68514-38-5","https://commonchemistry.cas.org/detail?cas_rn=68514-38-5"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] |
group_key=hydrocarbons,c4-10-unsaturated||dimension=Environmental > media=Air > strata=Ground level > population_density=Rural (<1000 people/square mile); cas=68514-38-5; added Common Chemistry CAS names as altLabel: Hydrocarbons, C<sub>4-10</sub>-unsatd.; object_uuid=fo-58a245f5d3336a8b |
f246d701… |
cas_match_labels |
— |
{"68514-38-5":"exactMatch"} |
group_key=hydrocarbons,c4-10-unsaturated||dimension=Environmental > media=Air > strata=Ground level > population_density=Rural (<1000 people/square mile); group_sources=['ec_inventory']; cas_sources={'68514-38-5': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-58a245f5d3336a8b: {'68514-38-5': 'exactMatch'} |
Flow Object JSON
{
"flow_object_id": "fo-58a245f5d3336a8b",
"prefLabel": [
{
"@value": "trans,trans-2,4-Hexadiene",
"@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": "Hydrocarbons, C<sub>4-10</sub>-unsatd.",
"@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": "Hydrocarbons,c4-10-unsaturated",
"@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": [
"C6H10"
],
"rdfs:label": "Molecular formula",
"provenance": [
{
"prov:wasGeneratedBy": "enrich_references.pubchem_semantic",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:638071"
],
"prov:wasDerivedFrom": "pubchem.props.Molecular Formula"
},
{
"prov:wasGeneratedBy": "rdkit_post_consensus",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"C/C=C/C=C/C"
]
}
]
},
"https://w3id.org/chemrof/inchi2d_key_string": {
"@id": "https://w3id.org/chemrof/inchi2d_key_string",
"@value": [
"APPOKADJQUIAHP-GGWOSOGESA-N"
],
"rdfs:label": "InChIKey",
"provenance": [
{
"prov:wasGeneratedBy": "enrich_references.pubchem_semantic",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:638071"
],
"prov:wasDerivedFrom": "pubchem.props.InChIKey"
},
{
"prov:wasGeneratedBy": "rdkit_post_consensus",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"C/C=C/C=C/C"
]
}
]
},
"https://w3id.org/chemrof/smiles_string": {
"@id": "https://w3id.org/chemrof/smiles_string",
"@value": [
"C/C=C/C=C/C",
"CC=CC=CC"
],
"rdfs:label": "SMILES",
"provenance": [
{
"prov:wasGeneratedBy": "enrich_references.pubchem_semantic",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:638071"
],
"prov:wasDerivedFrom": "pubchem.props.SMILES"
},
{
"prov:wasGeneratedBy": "rdkit_post_consensus",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"C/C=C/C=C/C"
]
}
]
},
"https://w3id.org/chemrof/inchi2d_string": {
"@id": "https://w3id.org/chemrof/inchi2d_string",
"@value": [
"InChI=1S/C6H10/c1-3-5-6-4-2/h3-6H,1-2H3/b5-3+,6-4+"
],
"rdfs:label": "InChI",
"provenance": [
{
"prov:wasGeneratedBy": "enrich_references.pubchem_semantic",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:638071"
],
"prov:wasDerivedFrom": "pubchem.props.InChI"
},
{
"prov:wasGeneratedBy": "rdkit_post_consensus",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"C/C=C/C=C/C"
]
}
]
},
"https://w3id.org/chemrof/IUPAC_name": {
"@id": "https://w3id.org/chemrof/IUPAC_name",
"@value": [
"(2E,4E)-hexa-2,4-diene"
],
"rdfs:label": "IUPAC name",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_semantic",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:638071"
],
"prov:wasDerivedFrom": "pubchem.identifiers.IUPAC Name"
}
},
"https://w3id.org/chemrof/molecular_mass": {
"@id": "https://w3id.org/chemrof/molecular_mass",
"rdfs:label": "Molecular mass",
"@value": [
"82.146"
],
"provenance": [
{
"prov:wasGeneratedBy": "rdkit_pre_consensus",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"C/C=C/C=C/C"
]
},
{
"prov:wasGeneratedBy": "rdkit_post_consensus",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"C/C=C/C=C/C"
]
}
],
"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": [
"82.07825"
],
"provenance": [
{
"prov:wasGeneratedBy": "rdkit_pre_consensus",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"C/C=C/C=C/C"
]
},
{
"prov:wasGeneratedBy": "rdkit_post_consensus",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"C/C=C/C=C/C"
]
}
],
"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=J147.953I",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:638071;CAS:68514-38-5"
],
"prov:wasDerivedFrom": "pubchem.identifiers[68514-38-5]"
}
},
{
"@id": "http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J94.862D",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:638071;CAS:68514-38-5"
],
"prov:wasDerivedFrom": "pubchem.identifiers[68514-38-5]"
}
},
{
"@id": "https://chem.echa.europa.eu/100.023.619",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:638071;CAS:68514-38-5"
],
"prov:wasDerivedFrom": "pubchem.identifiers[68514-38-5]"
}
},
{
"@id": "https://commonchemistry.cas.org/detail?cas_rn=5194-51-4",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:638071;CAS:68514-38-5"
],
"prov:wasDerivedFrom": "pubchem.identifiers[68514-38-5]"
}
},
{
"@id": "https://commonchemistry.cas.org/detail?cas_rn=68514-38-5",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.consensus_cas_link",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"68514-38-5"
],
"prov:wasDerivedFrom": "cas_numbers"
}
},
{
"@id": "https://comptox.epa.gov/dashboard/DTXSID10859501",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:638071;CAS:68514-38-5"
],
"prov:wasDerivedFrom": "pubchem.identifiers[68514-38-5]"
}
},
{
"@id": "https://gsrs.ncats.nih.gov/ginas/app/beta/substances/8NFN12O8UQ",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:638071;CAS:68514-38-5"
],
"prov:wasDerivedFrom": "pubchem.identifiers[68514-38-5]"
}
},
{
"@id": "https://pubchem.ncbi.nlm.nih.gov/compound/638071",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_compound",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:638071;CAS:68514-38-5"
],
"prov:wasDerivedFrom": "pubchem.by_cas[68514-38-5]"
}
},
{
"@id": "https://www.wikidata.org/wiki/Q27270785",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:638071;CAS:68514-38-5"
],
"prov:wasDerivedFrom": "pubchem.identifiers[68514-38-5]"
}
}
],
"created_from": {
"resolver": "hybrid_name_cas_v1",
"seed_uuid": "2926a99e-7da2-41f1-bff8-c3011e0a9d77",
"seed_source": "EF 3.1"
},
"classifications": {
"http://semanticscience.org/resource/CHEMINF_000446": {
"@value": [
"68514-38-5"
],
"rdfs:seeAlso": [
"https://commonchemistry.cas.org/detail?cas_rn=68514-38-5"
],
"skos:exactMatch": [
{
"@id": "https://commonchemistry.cas.org/detail?cas_rn=68514-38-5"
}
],
"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": [
"271-040-6"
],
"rdfs:seeAlso": [
"https://echa.europa.eu/search-for-chemicals?query=271-040-6"
],
"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
}