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CHEBI:174072 - Neryl propionate

ChEBI IDCHEBI:174072
ChEBI NameNeryl propionate
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC13H22O2
Net Charge0
Average Mass210.317
Monoisotopic Mass210.16198
SMILESCCC(=O)OC/C=C(/C)CCC=C(C)C
InChIInChI=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-
InChIKeyBYCHQEILESTMQU-XFXZXTDPSA-N
ChEBI Ontology
Outgoing Relation(s)
Neryl propionate (CHEBI:174072) is a carboxylic ester (CHEBI:33308)
IUPAC Name 
[(2Z)-3,7-dimethylocta-2,6-dienyl] propanoate
Manual XrefsDatabases
4517915ChemSpider
HMDB0038258HMDB
LMFA07010976LIPID MAPS
Registry NumbersSources
CAS:105-91-9ChemIDplus