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CHEBI:149579 - 3-hydroxynonyl acetate

ChEBI IDCHEBI:149579
ChEBI Name3-hydroxynonyl acetate
Stars
DefinitionAn acetate ester resulting from the formal condensation of the carboxy group of acetic acid with 1-hydroxy group of nonane-1,3-diol.
Last Modified20 July 2020
Submittermwilliams
DownloadsMolfile
FormulaC11H22O3
Net Charge0
Average Mass202.294
Monoisotopic Mass202.15689
SMILESCCCCCCC(O)CCOC(C)=O
InChIInChI=1S/C11H22O3/c1-3-4-5-6-7-11(13)8-9-14-10(2)12/h11,13H,3-9H2,1-2H3
InChIKeyRTYFAKSWXDNPPU-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
3-hydroxynonyl acetate (CHEBI:149579) is a acetate ester (CHEBI:47622)
3-hydroxynonyl acetate (CHEBI:149579) is a secondary alcohol (CHEBI:35681)
IUPAC Name 
3-hydroxynonyl acetate
Synonyms  Source
1,3-nonanediol acetateChemIDplus
1,3-nonanediol monoacetateChemIDplus
Manual XrefsDatabases
LMFA07010753LIPID MAPS
HMDB0032443HMDB
FDB016746FooDB
Registry NumbersSources
CAS:1322-17-4ChemIDplus