CHEBI:174072 - Neryl propionate

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ChEBI Name Neryl propionate
ChEBI ID CHEBI:174072
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
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Formula C13H22O2
Net Charge 0
Average Mass 210.317
Monoisotopic Mass 210.16198
InChI InChI=1S/C13H22O2/c1-5-13(14)15-10-9-12(4)8-6-7-11(2)3/h7,9H,5-6,8,10H2,1-4H3/b12-9-
InChIKey BYCHQEILESTMQU-XFXZXTDPSA-N
SMILES O(C/C=C(\CCC=C(C)C)/C)C(=O)CC
ChEBI Ontology
Outgoing Neryl propionate (CHEBI:174072) is a carboxylic ester (CHEBI:33308)
IUPAC Name
[(2Z)-3,7-dimethylocta-2,6-dienyl] propanoate
Manual Xrefs Databases
4517915 ChemSpider
HMDB0038258 HMDB
LMFA07010976 LIPID MAPS
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Registry Number Type Source
105-91-9 CAS Registry Number ChemIDplus