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2-methylcyclohexanone

UUID 03d773d3-5a32-4711-a2e6-3dfaa0ce5ead
Flow Object IDfo-af913df38a90c732
Source EF 3.1
Context Environmental → Water → Surface water
CAS Numbers 583-60-8
EC Numbers 209-513-6
prefLabel
Language Value Provenance
en 2-methylcyclohexanone
altLabel ⓘ
Language Value Provenance
en 2-methyl-1-cyclohexanone
en 2-methylcyclohexan-1-one
en 2-methylcyclohexane-1-one
en FEMA 3946
en alpha-methylcyclohexanone
en o-methylcyclohexanone
en ortho-methylcyclohexanone
en tetrahydro-o-cresol
en (±)-2-Methylcyclohexanone
en Cyclohexanone, 2-methyl-
en NSC 524
en α-Methylcyclohexanone
Definitions
Language Value Provenance
en A member of the class of cyclohexanones that is cyclohexanone substituted by a methyl group at position 2.
References
Shared Properties
Predicate Value
Formal charge 0
InChIKey LFSAPCRASZRSKS-UHFFFAOYSA-N
InChI InChI=1S/C7H12O/c1-6-4-2-3-5-7(6)8/h6H,2-5H2,1H3
IUPAC name 2-methyl-1-cyclohexanone, 2-methylcyclohexan-1-one, 2-methylcyclohexanone
Molecular formula C7H12O
Molecular mass 112.172
Monoisotopic mass 112.08882
SMILES CC1CCCCC1=O

Source List References

List Version Source Flow UUID Source Flow Name
EF 3.1 03d773d3-5a32-4711-a2e6-3dfaa0ce5ead 2-methylcyclohexanone

Concept Associations

Source List Source Flow Source Context Unit Match Type Conversion Provenance
EF 3.1 2-methylcyclohexanone Emissions/Emissions to water/Emissions to fresh water 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=2-methylcyclohexanone||dimension=Environmental > media=Water > water_body=Surface water; cas=583-60-8; added Common Chemistry CAS names as altLabel: (±)-2-Methylcyclohexanone, Cyclohexanone, 2-methyl-, NSC 524, α-Methylcyclohexanone; object_uuid=fo-af913df38a90c732
cas_match_labels 1 — consensus_match group_key=2-methylcyclohexanone||dimension=Environmental > media=Water > water_body=Surface water; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'583-60-8': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-af913df38a90c732: {'583-60-8': 'exactMatch'}

Context Attributes

AttributeValue
dimensionEnvironmental
mediaWater
water_bodySurface water

Consensus Changes

Field Old Value New Value Comment
altLabel [{'@value': '2-methyl-1-cyclohexanone', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:2-methyl-1-cyclohexanone', 'http://purl.obolibrary.org/obo/CHEBI_195390', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '2-methylcyclohexan-1-one', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:2-methylcyclohexan-1-one', 'http://purl.obolibrary.org/obo/CHEBI_195390', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '2-methylcyclohexane-1-one', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:2-methylcyclohexane-1-one', 'http://purl.obolibrary.org/obo/CHEBI_195390', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'FEMA 3946', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:FEMA 3946', 'http://purl.obolibrary.org/obo/CHEBI_195390', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'alpha-methylcyclohexanone', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:alpha-methylcyclohexanone', 'http://purl.obolibrary.org/obo/CHEBI_195390', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'o-methylcyclohexanone', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:o-methylcyclohexanone', 'http://purl.obolibrary.org/obo/CHEBI_195390', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'ortho-methylcyclohexanone', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:ortho-methylcyclohexanone', 'http://purl.obolibrary.org/obo/CHEBI_195390', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'tetrahydro-o-cresol', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:tetrahydro-o-cresol', 'http://purl.obolibrary.org/obo/CHEBI_195390', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}] [{'@value': '2-methyl-1-cyclohexanone', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:2-methyl-1-cyclohexanone', 'http://purl.obolibrary.org/obo/CHEBI_195390', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '2-methylcyclohexan-1-one', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:2-methylcyclohexan-1-one', 'http://purl.obolibrary.org/obo/CHEBI_195390', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '2-methylcyclohexane-1-one', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:2-methylcyclohexane-1-one', 'http://purl.obolibrary.org/obo/CHEBI_195390', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'FEMA 3946', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:FEMA 3946', 'http://purl.obolibrary.org/obo/CHEBI_195390', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'alpha-methylcyclohexanone', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:alpha-methylcyclohexanone', 'http://purl.obolibrary.org/obo/CHEBI_195390', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'o-methylcyclohexanone', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:o-methylcyclohexanone', 'http://purl.obolibrary.org/obo/CHEBI_195390', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'ortho-methylcyclohexanone', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:ortho-methylcyclohexanone', 'http://purl.obolibrary.org/obo/CHEBI_195390', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'tetrahydro-o-cresol', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:tetrahydro-o-cresol', 'http://purl.obolibrary.org/obo/CHEBI_195390', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '(±)-2-Methylcyclohexanone', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:583-60-8', 'https://commonchemistry.cas.org/detail?cas_rn=583-60-8'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Cyclohexanone, 2-methyl-', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:583-60-8', 'https://commonchemistry.cas.org/detail?cas_rn=583-60-8'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'NSC 524', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:583-60-8', 'https://commonchemistry.cas.org/detail?cas_rn=583-60-8'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'α-Methylcyclohexanone', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:583-60-8', 'https://commonchemistry.cas.org/detail?cas_rn=583-60-8'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}] group_key=2-methylcyclohexanone||dimension=Environmental > media=Water > water_body=Surface water; cas=583-60-8; added Common Chemistry CAS names as altLabel: (±)-2-Methylcyclohexanone, Cyclohexanone, 2-methyl-, NSC 524, α-Methylcyclohexanone; object_uuid=fo-af913df38a90c732
cas_match_labels None {'583-60-8': 'exactMatch'} group_key=2-methylcyclohexanone||dimension=Environmental > media=Water > water_body=Surface water; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'583-60-8': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-af913df38a90c732: {'583-60-8': 'exactMatch'}

PROV-O Consensus Activity Trail

No PROV-O consensus activities found for this flow.

Full Flow JSON

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