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Fatty Acids, C9-13-neo-

UUID 4fcbf7e7-1ad3-4873-be77-41e683fc6fcd
Deprecated yes
Replaced By 61803f12-df53-4525-8aa3-6a7418abf558
Flow Object IDfo-3ec9b7c12eff9ad6
Source EF 3.1
Context Environmental → Water → Unknown
CAS Numbers 68938-07-8
EC Numbers 273-114-3
prefLabel
Language Value Provenance
en Fatty Acids, C9-13-neo-
altLabel ⓘ
Language Value Provenance
en Fatty acids, C<sub>9-13</sub>-neo-
en Neo 913 Acid
References
Shared Properties
Predicate Value
InChIKey FZUWYUIYVKESIP-UHFFFAOYSA-N, ZNBZNWFTONMVPR-UHFFFAOYSA-M
InChI InChI=1S/C12H24O2/c1-12(2,3)10-8-6-4-5-7-9-11(13)14/h4-10H2,1-3H3,(H,13,14), InChI=1S/C21H36O4.Na/c1-2-3-4-9-12-18-15-14-17(16-19(18)21(24)25)11-8-6-5-7-10-13-20(22)23;/h14-15,17-19H,2-13,16H2,1H3,(H,22,23)(H,24,25);/q;+1/p-1
IUPAC name 9,9-dimethylcapric acid, 9,9-dimethyldecanoic acid, sodium 8-(5-carboxy-4-hexyl-1-cyclohex-2-enyl)octanoate, sodium 8-(5-carboxy-4-hexyl-cyclohex-2-en-1-yl)caprylate, sodium 8-(5-carboxy-4-hexyl-cyclohex-2-en-1-yl)octanoate, sodium 8-(5-carboxy-4-hexylcyclohex-2-en-1-yl)octanoate
Molecular formula C12H24O2, C21H35NaO4
SMILES CC(C)(C)CCCCCCCC(=O)O, CCCCCCC1C=CC(CC1C(=O)O)CCCCCCCC(=O)[O-].[Na+]

Source List References

List Version Source Flow UUID Source Flow Name
EF 3.1 4fcbf7e7-1ad3-4873-be77-41e683fc6fcd fatty acids, c9-13-neo-

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=fattyacids,c9-13-neo-||dimension=Environmental > media=Ground > geography=Agricultural; cas=68938-07-8; added Common Chemistry CAS names as altLabel: Fatty acids, C<sub>9-13</sub>-neo-, Neo 913 Acid; object_uuid=fo-3ec9b7c12eff9ad6
cas_match_labels 1 — consensus_match group_key=fattyacids,c9-13-neo-||dimension=Environmental > media=Ground > geography=Agricultural; group_sources=['ec_inventory']; cas_sources={'68938-07-8': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-3ec9b7c12eff9ad6: {'68938-07-8': 'exactMatch'}

Context Attributes

AttributeValue
dimensionEnvironmental
mediaWater
water_bodyUnknown

Consensus Changes

Field Old Value New Value Comment
altLabel None [{'@value': 'Fatty acids, C<sub>9-13</sub>-neo-', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:68938-07-8', 'https://commonchemistry.cas.org/detail?cas_rn=68938-07-8'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Neo 913 Acid', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:68938-07-8', 'https://commonchemistry.cas.org/detail?cas_rn=68938-07-8'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}] group_key=fattyacids,c9-13-neo-||dimension=Environmental > media=Ground > geography=Agricultural; cas=68938-07-8; added Common Chemistry CAS names as altLabel: Fatty acids, C<sub>9-13</sub>-neo-, Neo 913 Acid; object_uuid=fo-3ec9b7c12eff9ad6
cas_match_labels None {'68938-07-8': 'exactMatch'} group_key=fattyacids,c9-13-neo-||dimension=Environmental > media=Ground > geography=Agricultural; group_sources=['ec_inventory']; cas_sources={'68938-07-8': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-3ec9b7c12eff9ad6: {'68938-07-8': 'exactMatch'}

PROV-O Consensus Activity Trail

No PROV-O consensus activities found for this flow.

Full Flow JSON

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