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4-(1,1-dimethylethyl)-cyclohexanone

UUID b4011b48-fe9d-473e-966f-e27e0ac0a455
Flow Object IDfo-5c6c67d1ed16c395
Source EF 3.1
Context Environmental → Air → Unknown
CAS Numbers 98-53-3
EC Numbers 202-678-5
prefLabel
Language Value Provenance
en 4-(1,1-dimethylethyl)-cyclohexanone
altLabel ⓘ
Language Value Provenance
en 4-tert-butylcyclohexan-1-one
en 4-(1,1-Dimethylethyl)cyclohexanone
en 4-<em>tert</em>-Butylcyclohexanone
en <em>p</em>-<em>tert</em>-Butylcyclohexanone
en C 64
en Cyclohexanone, 4-(1,1-dimethylethyl)-
en Cyclohexanone, 4-<em>tert</em>-butyl-
en NSC 73717
en γ-<em>tert</em>-Butylcyclohexanone
References
Shared Properties
Predicate Value
Formal charge 0
InChIKey YKFKEYKJGVSEIX-UHFFFAOYSA-N
InChI InChI=1S/C10H18O/c1-10(2,3)8-4-6-9(11)7-5-8/h8H,4-7H2,1-3H3
IUPAC name 4-tert-butyl-1-cyclohexanone, 4-tert-butylcyclohexan-1-one, 4-tert-butylcyclohexanone
Molecular formula C10H18O
Molecular mass 154.253
Monoisotopic mass 154.13577
SMILES CC(C)(C)C1CCC(=O)CC1

Source List References

List Version Source Flow UUID Source Flow Name
EF 3.1 b4011b48-fe9d-473e-966f-e27e0ac0a455 4-(1,1-dimethylethyl)-cyclohexanone

Concept Associations

Source List Source Flow Source Context Unit Match Type Conversion Provenance
EF 3.1 4-(1,1-dimethylethyl)-cyclohexanone Emissions/Emissions to air/Emissions to air, unspecified 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=4-(1,1-dimethylethyl)-cyclohexanone||dimension=Environmental > media=Water > water_body=Surface water; cas=98-53-3; added Common Chemistry CAS names as altLabel: 4-(1,1-Dimethylethyl)cyclohexanone, 4-<em>tert</em>-Butylcyclohexanone, <em>p</em>-<em>tert</em>-Butylcyclohexanone, C 64, Cyclohexanone, 4-(1,1-dimethylethyl)-, Cyclohexanone, 4-<em>tert</em>-butyl-, NSC 73717, γ-<em>tert</em>-Butylcyclohexanone; object_uuid=fo-5c6c67d1ed16c395
cas_match_labels 1 — consensus_match group_key=4-(1,1-dimethylethyl)-cyclohexanone||dimension=Environmental > media=Water > water_body=Surface water; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'98-53-3': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-5c6c67d1ed16c395: {'98-53-3': 'exactMatch'}

Context Attributes

AttributeValue
dimensionEnvironmental
mediaAir
strataUnknown

Consensus Changes

Field Old Value New Value Comment
altLabel [{'@value': '4-tert-butylcyclohexan-1-one', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:4-tert-butylcyclohexan-1-one', 'http://purl.obolibrary.org/obo/CHEBI_188365', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}] [{'@value': '4-tert-butylcyclohexan-1-one', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:4-tert-butylcyclohexan-1-one', 'http://purl.obolibrary.org/obo/CHEBI_188365', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '4-(1,1-Dimethylethyl)cyclohexanone', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:98-53-3', 'https://commonchemistry.cas.org/detail?cas_rn=98-53-3'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '4-<em>tert</em>-Butylcyclohexanone', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:98-53-3', 'https://commonchemistry.cas.org/detail?cas_rn=98-53-3'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '<em>p</em>-<em>tert</em>-Butylcyclohexanone', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:98-53-3', 'https://commonchemistry.cas.org/detail?cas_rn=98-53-3'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'C 64', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:98-53-3', 'https://commonchemistry.cas.org/detail?cas_rn=98-53-3'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Cyclohexanone, 4-(1,1-dimethylethyl)-', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:98-53-3', 'https://commonchemistry.cas.org/detail?cas_rn=98-53-3'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Cyclohexanone, 4-<em>tert</em>-butyl-', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:98-53-3', 'https://commonchemistry.cas.org/detail?cas_rn=98-53-3'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'NSC 73717', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:98-53-3', 'https://commonchemistry.cas.org/detail?cas_rn=98-53-3'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'γ-<em>tert</em>-Butylcyclohexanone', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:98-53-3', 'https://commonchemistry.cas.org/detail?cas_rn=98-53-3'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}] group_key=4-(1,1-dimethylethyl)-cyclohexanone||dimension=Environmental > media=Water > water_body=Surface water; cas=98-53-3; added Common Chemistry CAS names as altLabel: 4-(1,1-Dimethylethyl)cyclohexanone, 4-<em>tert</em>-Butylcyclohexanone, <em>p</em>-<em>tert</em>-Butylcyclohexanone, C 64, Cyclohexanone, 4-(1,1-dimethylethyl)-, Cyclohexanone, 4-<em>tert</em>-butyl-, NSC 73717, γ-<em>tert</em>-Butylcyclohexanone; object_uuid=fo-5c6c67d1ed16c395
cas_match_labels None {'98-53-3': 'exactMatch'} group_key=4-(1,1-dimethylethyl)-cyclohexanone||dimension=Environmental > media=Water > water_body=Surface water; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'98-53-3': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-5c6c67d1ed16c395: {'98-53-3': 'exactMatch'}

PROV-O Consensus Activity Trail

No PROV-O consensus activities found for this flow.

Full Flow JSON

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