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Allyl caproate

UUID 5698fad6-124a-4326-9c89-a07864a29165
Flow Object IDfo-e3a1ee476bd6def9
Source EF 3.1
Context Environmental → Air → Ground level → Rural (<1000 people/square mile)
CAS Numbers 123-68-2
EC Numbers 204-642-4
prefLabel
Language Value Provenance
en Allyl caproate
altLabel
Language Value Provenance
en prop-2-enyl hexanoate
en 2-Propenyl hexanoate
en Allyl alcohol, hexanoate
en Allyl capronate
en Caproic acid allyl ester
en Hexanoic acid, 2-propen-1-yl ester
en Hexanoic acid, 2-propenyl ester
en Hexanoic acid, allyl ester
en NSC 20962
en Allyl Hexanoate
References
Shared Properties
Predicate Value
Formal charge 0
InChIKey RCSBILYQLVXLJG-UHFFFAOYSA-N
InChI InChI=1S/C9H16O2/c1-3-5-6-7-9(10)11-8-4-2/h4H,2-3,5-8H2,1H3
IUPAC name allyl hexanoate, hexanoic acid allyl ester, hexanoic acid prop-2-enyl ester, prop-2-enyl hexanoate
Molecular formula C9H16O2
Molecular mass 156.225
Monoisotopic mass 156.11503
SMILES C=CCOC(=O)CCCCC, CCCCCC(=O)OCC=C

Source List References

List Version Source Flow UUID Source Flow Name
EF 3.1 5698fad6-124a-4326-9c89-a07864a29165 allyl hexanoate

Concept Associations

Source List Source Flow Source Context Unit Match Type Conversion Provenance
EF 3.1 allyl hexanoate Emissions/Emissions to air/Emissions to air, unspecified (long-term) kg exactMatch

Consolidated Field Provenance

0 total PROV activity record(s) for this flow.

Field Change Count Latest Time Transformers Latest Comment
altLabel 1 consensus_match group_key=allylhexanoate||dimension=Environmental > media=Air > strata=High stack, >150 meters; cas=123-68-2; added Common Chemistry CAS names as altLabel: 2-Propenyl hexanoate, Allyl alcohol, hexanoate, Allyl caproate, Allyl capronate, Caproic acid allyl ester, Hexanoic acid, 2-propen-1-yl ester, Hexanoic acid, 2-propenyl ester, Hexanoic acid, allyl ester, NSC 20962; object_uuid=fo-e3a1ee476bd6def9
cas_match_labels 1 consensus_match group_key=allylhexanoate||dimension=Environmental > media=Air > strata=High stack, >150 meters; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'123-68-2': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-e3a1ee476bd6def9: {'123-68-2': 'exactMatch'}

Context Attributes

AttributeValue
dimensionEnvironmental
mediaAir
strataGround level
population_densityRural (<1000 people/square mile)

Consensus Changes

Field Old Value New Value Comment
altLabel [{'@value': 'prop-2-enyl hexanoate', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:prop-2-enyl hexanoate', 'http://purl.obolibrary.org/obo/CHEBI_171771', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}] [{'@value': 'prop-2-enyl hexanoate', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:prop-2-enyl hexanoate', 'http://purl.obolibrary.org/obo/CHEBI_171771', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '2-Propenyl hexanoate', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:123-68-2', 'https://commonchemistry.cas.org/detail?cas_rn=123-68-2'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Allyl alcohol, hexanoate', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:123-68-2', 'https://commonchemistry.cas.org/detail?cas_rn=123-68-2'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Allyl caproate', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:123-68-2', 'https://commonchemistry.cas.org/detail?cas_rn=123-68-2'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Allyl capronate', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:123-68-2', 'https://commonchemistry.cas.org/detail?cas_rn=123-68-2'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Caproic acid allyl ester', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:123-68-2', 'https://commonchemistry.cas.org/detail?cas_rn=123-68-2'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Hexanoic acid, 2-propen-1-yl ester', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:123-68-2', 'https://commonchemistry.cas.org/detail?cas_rn=123-68-2'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Hexanoic acid, 2-propenyl ester', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:123-68-2', 'https://commonchemistry.cas.org/detail?cas_rn=123-68-2'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Hexanoic acid, allyl ester', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:123-68-2', 'https://commonchemistry.cas.org/detail?cas_rn=123-68-2'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'NSC 20962', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:123-68-2', 'https://commonchemistry.cas.org/detail?cas_rn=123-68-2'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}] group_key=allylhexanoate||dimension=Environmental > media=Air > strata=High stack, >150 meters; cas=123-68-2; added Common Chemistry CAS names as altLabel: 2-Propenyl hexanoate, Allyl alcohol, hexanoate, Allyl caproate, Allyl capronate, Caproic acid allyl ester, Hexanoic acid, 2-propen-1-yl ester, Hexanoic acid, 2-propenyl ester, Hexanoic acid, allyl ester, NSC 20962; object_uuid=fo-e3a1ee476bd6def9
cas_match_labels None {'123-68-2': 'exactMatch'} group_key=allylhexanoate||dimension=Environmental > media=Air > strata=High stack, >150 meters; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'123-68-2': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-e3a1ee476bd6def9: {'123-68-2': 'exactMatch'}

PROV-O Consensus Activity Trail

No PROV-O consensus activities found for this flow.

Full Flow JSON

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