← Back to consensus flow objects
2-methylnonane
Provenance
| Field | Value |
|---|---|
| Resolver | hybrid_name_cas_v1 |
| Seed Source | EF 3.1 |
| Seed Flow | 172ada01-6556-11dd-ad8b-0800200c9a66 |
Properties
| Predicate | Value |
|---|---|
| InChIKey |
SGVYKUFIHHTIFL-UHFFFAOYSA-N
|
| InChI |
InChI=1S/C10H22/c1-4-5-6-7-8-9-10(2)3/h10H,4-9H2,1-3H3
|
| IUPAC name |
2-methylnonane
|
| Molecular formula |
C10H22
|
| Molecular mass |
142.286
|
| Monoisotopic mass |
142.172151
|
| SMILES |
CCCCCCCC(C)C
|
References
- http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J95.545K
- https://chem.echa.europa.eu/100.011.649
- https://chem.echa.europa.eu/100.047.305
- https://commonchemistry.cas.org/detail?cas_rn=34464-38-5
- https://commonchemistry.cas.org/detail?cas_rn=871-83-0
- https://comptox.epa.gov/dashboard/DTXSID80873239
- https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=24849
- https://en.wikipedia.org/wiki/2-Methylnonane
- https://gsrs.ncats.nih.gov/ginas/app/beta/substances/382AKH052V
- https://lipidmaps.org/databases/lmsd/LMFA11000615
- https://pubchem.ncbi.nlm.nih.gov/compound/13379
- https://www.metabolomicsworkbench.org/data/StructureData.php?RegNo=5310
- https://www.wikidata.org/wiki/Q2813818
Linked Elementary Flows
| UUID | Source | Unit | Context | LCIA Factors | Consensus Changes |
|---|---|---|---|---|---|
172ada03… |
EF 3.1 | kg | Environmental → Air → Aircraft cruise height | 0 | 2 |
4d9a8790… |
EF 3.1 | kg | Environmental → Air → Ground level → Rural (<1000 people/square mile) | 0 | 2 |
4d9a8790… |
EF 3.1 | kg | Environmental → Air → Ground level → Urban (>1000 people/square mile) | 0 | 2 |
4d9a8790… |
EF 3.1 | kg | Environmental → Air → High stack, >150 meters | 0 | 2 |
4d9a8790… |
EF 3.1 | kg | Environmental → Air → Unknown | 0 | 2 |
172ada01… |
EF 3.1 | kg | Environmental → Ground → Agricultural | 0 | 2 |
172ada04… |
EF 3.1 | kg | Environmental → Ground → Unknown | 0 | 2 |
172ada05… |
EF 3.1 | kg | Environmental → Water → Ocean | 0 | 2 |
172ada02… |
EF 3.1 | kg | Environmental → Water → Surface water | 0 | 2 |
172ada07… |
EF 3.1 | kg | Environmental → Water → Unknown | 0 | 2 |
▶
Changes Applied
| Elementary Flow | Field | Old Value | New Value | Comment |
|---|---|---|---|---|
172ada01… |
altLabel |
— |
[{"@value":"NSC 24849","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:871-83-0","https://commonchemistry.cas.org/detail?cas_rn=871-83-0"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"Nonane, 2-methyl-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:871-83-0","https://commonchemistry.cas.org/detail?cas_rn=871-83-0"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] |
group_key=2-methylnonane||dimension=Environmental > media=Ground > geography=Agricultural; cas=871-83-0; added Common Chemistry CAS names as altLabel: NSC 24849, Nonane, 2-methyl-; object_uuid=fo-3a8a4abf71939f9c |
172ada01… |
cas_match_labels |
— |
{"871-83-0":"exactMatch"} |
group_key=2-methylnonane||dimension=Environmental > media=Ground > geography=Agricultural; group_sources=['ec_inventory', 'pubchem']; cas_sources={'871-83-0': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-3a8a4abf71939f9c: {'871-83-0': 'exactMatch'} |
172ada02… |
altLabel |
— |
[{"@value":"NSC 24849","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:871-83-0","https://commonchemistry.cas.org/detail?cas_rn=871-83-0"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"Nonane, 2-methyl-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:871-83-0","https://commonchemistry.cas.org/detail?cas_rn=871-83-0"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] |
group_key=2-methylnonane||dimension=Environmental > media=Ground > geography=Agricultural; cas=871-83-0; added Common Chemistry CAS names as altLabel: NSC 24849, Nonane, 2-methyl-; object_uuid=fo-3a8a4abf71939f9c |
172ada02… |
cas_match_labels |
— |
{"871-83-0":"exactMatch"} |
group_key=2-methylnonane||dimension=Environmental > media=Ground > geography=Agricultural; group_sources=['ec_inventory', 'pubchem']; cas_sources={'871-83-0': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-3a8a4abf71939f9c: {'871-83-0': 'exactMatch'} |
172ada03… |
altLabel |
— |
[{"@value":"NSC 24849","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:871-83-0","https://commonchemistry.cas.org/detail?cas_rn=871-83-0"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"Nonane, 2-methyl-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:871-83-0","https://commonchemistry.cas.org/detail?cas_rn=871-83-0"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] |
group_key=2-methylnonane||dimension=Environmental > media=Ground > geography=Agricultural; cas=871-83-0; added Common Chemistry CAS names as altLabel: NSC 24849, Nonane, 2-methyl-; object_uuid=fo-3a8a4abf71939f9c |
172ada03… |
cas_match_labels |
— |
{"871-83-0":"exactMatch"} |
group_key=2-methylnonane||dimension=Environmental > media=Ground > geography=Agricultural; group_sources=['ec_inventory', 'pubchem']; cas_sources={'871-83-0': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-3a8a4abf71939f9c: {'871-83-0': 'exactMatch'} |
172ada04… |
altLabel |
— |
[{"@value":"NSC 24849","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:871-83-0","https://commonchemistry.cas.org/detail?cas_rn=871-83-0"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"Nonane, 2-methyl-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:871-83-0","https://commonchemistry.cas.org/detail?cas_rn=871-83-0"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] |
group_key=2-methylnonane||dimension=Environmental > media=Ground > geography=Agricultural; cas=871-83-0; added Common Chemistry CAS names as altLabel: NSC 24849, Nonane, 2-methyl-; object_uuid=fo-3a8a4abf71939f9c |
172ada04… |
cas_match_labels |
— |
{"871-83-0":"exactMatch"} |
group_key=2-methylnonane||dimension=Environmental > media=Ground > geography=Agricultural; group_sources=['ec_inventory', 'pubchem']; cas_sources={'871-83-0': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-3a8a4abf71939f9c: {'871-83-0': 'exactMatch'} |
172ada05… |
altLabel |
— |
[{"@value":"NSC 24849","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:871-83-0","https://commonchemistry.cas.org/detail?cas_rn=871-83-0"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"Nonane, 2-methyl-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:871-83-0","https://commonchemistry.cas.org/detail?cas_rn=871-83-0"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] |
group_key=2-methylnonane||dimension=Environmental > media=Ground > geography=Agricultural; cas=871-83-0; added Common Chemistry CAS names as altLabel: NSC 24849, Nonane, 2-methyl-; object_uuid=fo-3a8a4abf71939f9c |
172ada05… |
cas_match_labels |
— |
{"871-83-0":"exactMatch"} |
group_key=2-methylnonane||dimension=Environmental > media=Ground > geography=Agricultural; group_sources=['ec_inventory', 'pubchem']; cas_sources={'871-83-0': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-3a8a4abf71939f9c: {'871-83-0': 'exactMatch'} |
172ada06… |
altLabel |
— |
[{"@value":"NSC 24849","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:871-83-0","https://commonchemistry.cas.org/detail?cas_rn=871-83-0"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"Nonane, 2-methyl-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:871-83-0","https://commonchemistry.cas.org/detail?cas_rn=871-83-0"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] |
group_key=2-methylnonane||dimension=Environmental > media=Ground > geography=Agricultural; cas=871-83-0; added Common Chemistry CAS names as altLabel: NSC 24849, Nonane, 2-methyl-; object_uuid=fo-3a8a4abf71939f9c |
172ada06… |
cas_match_labels |
— |
{"871-83-0":"exactMatch"} |
group_key=2-methylnonane||dimension=Environmental > media=Ground > geography=Agricultural; group_sources=['ec_inventory', 'pubchem']; cas_sources={'871-83-0': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-3a8a4abf71939f9c: {'871-83-0': 'exactMatch'} |
172ada07… |
altLabel |
— |
[{"@value":"NSC 24849","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:871-83-0","https://commonchemistry.cas.org/detail?cas_rn=871-83-0"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"Nonane, 2-methyl-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:871-83-0","https://commonchemistry.cas.org/detail?cas_rn=871-83-0"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] |
group_key=2-methylnonane||dimension=Environmental > media=Ground > geography=Agricultural; cas=871-83-0; added Common Chemistry CAS names as altLabel: NSC 24849, Nonane, 2-methyl-; object_uuid=fo-3a8a4abf71939f9c |
172ada07… |
cas_match_labels |
— |
{"871-83-0":"exactMatch"} |
group_key=2-methylnonane||dimension=Environmental > media=Ground > geography=Agricultural; group_sources=['ec_inventory', 'pubchem']; cas_sources={'871-83-0': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-3a8a4abf71939f9c: {'871-83-0': 'exactMatch'} |
172ada08… |
altLabel |
— |
[{"@value":"NSC 24849","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:871-83-0","https://commonchemistry.cas.org/detail?cas_rn=871-83-0"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"Nonane, 2-methyl-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:871-83-0","https://commonchemistry.cas.org/detail?cas_rn=871-83-0"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] |
group_key=2-methylnonane||dimension=Environmental > media=Ground > geography=Agricultural; cas=871-83-0; added Common Chemistry CAS names as altLabel: NSC 24849, Nonane, 2-methyl-; object_uuid=fo-3a8a4abf71939f9c |
172ada08… |
cas_match_labels |
— |
{"871-83-0":"exactMatch"} |
group_key=2-methylnonane||dimension=Environmental > media=Ground > geography=Agricultural; group_sources=['ec_inventory', 'pubchem']; cas_sources={'871-83-0': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-3a8a4abf71939f9c: {'871-83-0': 'exactMatch'} |
4d9a8790… |
altLabel |
— |
[{"@value":"NSC 24849","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:871-83-0","https://commonchemistry.cas.org/detail?cas_rn=871-83-0"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"Nonane, 2-methyl-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:871-83-0","https://commonchemistry.cas.org/detail?cas_rn=871-83-0"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] |
group_key=2-methylnonane||dimension=Environmental > media=Ground > geography=Agricultural; cas=871-83-0; added Common Chemistry CAS names as altLabel: NSC 24849, Nonane, 2-methyl-; object_uuid=fo-3a8a4abf71939f9c |
4d9a8790… |
cas_match_labels |
— |
{"871-83-0":"exactMatch"} |
group_key=2-methylnonane||dimension=Environmental > media=Ground > geography=Agricultural; group_sources=['ec_inventory', 'pubchem']; cas_sources={'871-83-0': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-3a8a4abf71939f9c: {'871-83-0': 'exactMatch'} |
4d9a8790… |
altLabel |
— |
[{"@value":"NSC 24849","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:871-83-0","https://commonchemistry.cas.org/detail?cas_rn=871-83-0"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"Nonane, 2-methyl-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:871-83-0","https://commonchemistry.cas.org/detail?cas_rn=871-83-0"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] |
group_key=2-methylnonane||dimension=Environmental > media=Ground > geography=Agricultural; cas=871-83-0; added Common Chemistry CAS names as altLabel: NSC 24849, Nonane, 2-methyl-; object_uuid=fo-3a8a4abf71939f9c |
4d9a8790… |
cas_match_labels |
— |
{"871-83-0":"exactMatch"} |
group_key=2-methylnonane||dimension=Environmental > media=Ground > geography=Agricultural; group_sources=['ec_inventory', 'pubchem']; cas_sources={'871-83-0': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-3a8a4abf71939f9c: {'871-83-0': 'exactMatch'} |
4d9a8790… |
altLabel |
— |
[{"@value":"NSC 24849","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:871-83-0","https://commonchemistry.cas.org/detail?cas_rn=871-83-0"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"Nonane, 2-methyl-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:871-83-0","https://commonchemistry.cas.org/detail?cas_rn=871-83-0"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] |
group_key=2-methylnonane||dimension=Environmental > media=Ground > geography=Agricultural; cas=871-83-0; added Common Chemistry CAS names as altLabel: NSC 24849, Nonane, 2-methyl-; object_uuid=fo-3a8a4abf71939f9c |
4d9a8790… |
cas_match_labels |
— |
{"871-83-0":"exactMatch"} |
group_key=2-methylnonane||dimension=Environmental > media=Ground > geography=Agricultural; group_sources=['ec_inventory', 'pubchem']; cas_sources={'871-83-0': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-3a8a4abf71939f9c: {'871-83-0': 'exactMatch'} |
4d9a8790… |
altLabel |
— |
[{"@value":"NSC 24849","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:871-83-0","https://commonchemistry.cas.org/detail?cas_rn=871-83-0"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"Nonane, 2-methyl-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:871-83-0","https://commonchemistry.cas.org/detail?cas_rn=871-83-0"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] |
group_key=2-methylnonane||dimension=Environmental > media=Ground > geography=Agricultural; cas=871-83-0; added Common Chemistry CAS names as altLabel: NSC 24849, Nonane, 2-methyl-; object_uuid=fo-3a8a4abf71939f9c |
4d9a8790… |
cas_match_labels |
— |
{"871-83-0":"exactMatch"} |
group_key=2-methylnonane||dimension=Environmental > media=Ground > geography=Agricultural; group_sources=['ec_inventory', 'pubchem']; cas_sources={'871-83-0': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-3a8a4abf71939f9c: {'871-83-0': 'exactMatch'} |
Flow Object JSON
{
"flow_object_id": "fo-3a8a4abf71939f9c",
"prefLabel": [
{
"@value": "2-methylnonane",
"@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": "Nonane, 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 24849",
"@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": [
"C10H22"
],
"rdfs:label": "Molecular formula",
"provenance": [
{
"prov:wasGeneratedBy": "enrich_references.pubchem_semantic",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:13379"
],
"prov:wasDerivedFrom": "pubchem.props.Molecular Formula"
},
{
"prov:wasGeneratedBy": "rdkit_post_consensus",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CCCCCCCC(C)C"
]
}
]
},
"https://w3id.org/chemrof/inchi2d_key_string": {
"@id": "https://w3id.org/chemrof/inchi2d_key_string",
"@value": [
"SGVYKUFIHHTIFL-UHFFFAOYSA-N"
],
"rdfs:label": "InChIKey",
"provenance": [
{
"prov:wasGeneratedBy": "enrich_references.pubchem_semantic",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
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],
"prov:wasDerivedFrom": "pubchem.props.InChIKey"
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{
"prov:wasGeneratedBy": "rdkit_post_consensus",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CCCCCCCC(C)C"
]
}
]
},
"https://w3id.org/chemrof/smiles_string": {
"@id": "https://w3id.org/chemrof/smiles_string",
"@value": [
"CCCCCCCC(C)C"
],
"rdfs:label": "SMILES",
"provenance": [
{
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"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
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],
"prov:wasDerivedFrom": "pubchem.props.SMILES"
},
{
"prov:wasGeneratedBy": "rdkit_post_consensus",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CCCCCCCC(C)C"
]
}
]
},
"https://w3id.org/chemrof/inchi2d_string": {
"@id": "https://w3id.org/chemrof/inchi2d_string",
"@value": [
"InChI=1S/C10H22/c1-4-5-6-7-8-9-10(2)3/h10H,4-9H2,1-3H3"
],
"rdfs:label": "InChI",
"provenance": [
{
"prov:wasGeneratedBy": "enrich_references.pubchem_semantic",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
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],
"prov:wasDerivedFrom": "pubchem.props.InChI"
},
{
"prov:wasGeneratedBy": "rdkit_post_consensus",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CCCCCCCC(C)C"
]
}
]
},
"https://w3id.org/chemrof/IUPAC_name": {
"@id": "https://w3id.org/chemrof/IUPAC_name",
"@value": [
"2-methylnonane"
],
"rdfs:label": "IUPAC name",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_semantic",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
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],
"prov:wasDerivedFrom": "pubchem.identifiers.IUPAC Name"
}
},
"https://w3id.org/chemrof/molecular_mass": {
"@id": "https://w3id.org/chemrof/molecular_mass",
"rdfs:label": "Molecular mass",
"@value": [
"142.286"
],
"provenance": [
{
"prov:wasGeneratedBy": "rdkit_pre_consensus",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CCCCCCCC(C)C"
]
},
{
"prov:wasGeneratedBy": "rdkit_post_consensus",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CCCCCCCC(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": [
"142.172151"
],
"provenance": [
{
"prov:wasGeneratedBy": "rdkit_pre_consensus",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CCCCCCCC(C)C"
]
},
{
"prov:wasGeneratedBy": "rdkit_post_consensus",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CCCCCCCC(C)C"
]
}
],
"http://qudt.org/schema/qudt/hasUnit": "https://vocab.brightway.one/units/unit/GM-PER-MOL"
}
},
"references": [
{
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