3-methyl-5-(2,2,3-trimethylcyclopent-3-en-1-yl)pent-3-en-2-one

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3-methyl-5-(2,2,3-trimethylcyclopent-3-en-1-yl)pent-3-en-2-one

UUID 6a1de4b1-6e45-4938-a7cf-240027987b03

Flow Object ID fo-a170167d63300d73

Source EF 3.1

Context Environmental → Water → Unknown

CAS Numbers 65113-95-3

EC Numbers 265-450-4

prefLabel

Language	Value	Provenance
`en`	`3-methyl-5-(2,2,3-trimethylcyclopent-3-en-1-yl)pent-3-en-2-one`

altLabel ⓘ

Language	Value	Provenance
`en`	`3-Methyl-5-(2,2,3-trimethyl-3-cyclopenten-1-yl)-3-penten-2-one`
`en`	`3-Penten-2-one, 3-methyl-5-(2,2,3-trimethyl-3-cyclopenten-1-yl)-`

References

Shared Properties

Predicate	Value
InChIKey	`QQUWZMIGSXXJFV-PPOCWRSBSA-N, QQUWZMIGSXXJFV-UHFFFAOYSA-N, QQUWZMIGSXXJFV-UXBLZVDNSA-N`
InChI	`InChI=1S/C14H22O/c1-10(12(3)15)6-8-13-9-7-11(2)14(13,4)5/h6-7,13H,8-9H2,1-5H3, InChI=1S/C14H22O/c1-10(12(3)15)6-8-13-9-7-11(2)14(13,4)5/h6-7,13H,8-9H2,1-5H3/b10-6+, InChI=1S/C14H22O/c1-10(12(3)15)6-8-13-9-7-11(2)14(13,4)5/h6-7,13H,8-9H2,1-5H3/b10-6+/t13-/m0/s1`
IUPAC name	`(E)-3-methyl-5-(2,2,3-trimethyl-1-cyclopent-3-enyl)-3-penten-2-one, (E)-3-methyl-5-(2,2,3-trimethylcyclopent-3-en-1-yl)pent-3-en-2-one, (E)-3-methyl-5-[(1R)-2,2,3-trimethyl-1-cyclopent-3-enyl]-3-penten-2-one, (E)-3-methyl-5-[(1R)-2,2,3-trimethylcyclopent-3-en-1-yl]pent-3-en-2-one, 3-methyl-5-(2,2,3-trimethyl-1-cyclopent-3-enyl)-3-penten-2-one, 3-methyl-5-(2,2,3-trimethylcyclopent-3-en-1-yl)pent-3-en-2-one`
Molecular formula	`C14H22O`
SMILES	`CC1=CCC(C1(C)C)C/C=C(\C)/C(=O)C, CC1=CCC(C1(C)C)CC=C(C)C(=O)C, CC1=CC[C@@H](C1(C)C)C/C=C(\C)/C(=O)C`

Source List References

List	Version	Source Flow UUID	Source Flow Name
EF	3.1	`6a1de4b1-6e45-4938-a7cf-240027987b03`	3-methyl-5-(2,2,3-trimethylcyclopent-3-en-1-yl)pent-3-en-2-one

Concept Associations

Source List	Source Flow	Source Context	Unit	Match Type	Conversion	Provenance
EF 3.1	3-methyl-5-(2,2,3-trimethylcyclopent-3-en-1-yl)pent-3-en-2-one	Emissions/Emissions to water/Emissions to water, 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=3-methyl-5-(2,2,3-trimethylcyclopent-3-en-1-yl)pent-3-en-2-one\|\|dimension=Environmental > media=Air > strata=Unknown; cas=65113-95-3; added Common Chemistry CAS names as altLabel: 3-Methyl-5-(2,2,3-trimethyl-3-cyclopenten-1-yl)-3-penten-2-one, 3-Penten-2-one, 3-methyl-5-(2,2,3-trimethyl-3-cyclopenten-1-yl)-; object_uuid=fo-a170167d63300d73
`cas_match_labels`	1	`—`	consensus_match	group_key=3-methyl-5-(2,2,3-trimethylcyclopent-3-en-1-yl)pent-3-en-2-one\|\|dimension=Environmental > media=Air > strata=Unknown; group_sources=['ec_inventory', 'pubchem']; cas_sources={'65113-95-3': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-a170167d63300d73: {'65113-95-3': 'exactMatch'}

Context Attributes

Attribute	Value
dimension	Environmental
media	Water
water_body	Unknown

Consensus Changes

Field	Old Value	New Value	Comment
`altLabel`	`None`	[{'@value': '3-Methyl-5-(2,2,3-trimethyl-3-cyclopenten-1-yl)-3-penten-2-one', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:65113-95-3', 'https://commonchemistry.cas.org/detail?cas_rn=65113-95-3'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '3-Penten-2-one, 3-methyl-5-(2,2,3-trimethyl-3-cyclopenten-1-yl)-', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:65113-95-3', 'https://commonchemistry.cas.org/detail?cas_rn=65113-95-3'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}]	group_key=3-methyl-5-(2,2,3-trimethylcyclopent-3-en-1-yl)pent-3-en-2-one\|\|dimension=Environmental > media=Air > strata=Unknown; cas=65113-95-3; added Common Chemistry CAS names as altLabel: 3-Methyl-5-(2,2,3-trimethyl-3-cyclopenten-1-yl)-3-penten-2-one, 3-Penten-2-one, 3-methyl-5-(2,2,3-trimethyl-3-cyclopenten-1-yl)-; object_uuid=fo-a170167d63300d73
`cas_match_labels`	`None`	`{'65113-95-3': 'exactMatch'}`	group_key=3-methyl-5-(2,2,3-trimethylcyclopent-3-en-1-yl)pent-3-en-2-one\|\|dimension=Environmental > media=Air > strata=Unknown; group_sources=['ec_inventory', 'pubchem']; cas_sources={'65113-95-3': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-a170167d63300d73: {'65113-95-3': 'exactMatch'}

PROV-O Consensus Activity Trail

No PROV-O consensus activities found for this flow.

Full Flow JSON

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