CHEBI:180115 - nonyl butyrate

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name nonyl butyrate
ChEBI ID CHEBI:180115
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
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Formula C13H26O2
Net Charge 0
Average Mass 214.349
Monoisotopic Mass 214.19328
InChI InChI=1S/C13H26O2/c1-3-5-6-7-8-9-10-12-15-13(14)11-4-2/h3-12H2,1-2H3
InChIKey RVNCBAPCNVAWOY-UHFFFAOYSA-N
SMILES O(CCCCCCCCC)C(=O)CCC
ChEBI Ontology
Outgoing nonyl butyrate (CHEBI:180115) is a carboxylic ester (CHEBI:33308)
IUPAC Name
nonyl butanoate
Manual Xrefs Databases
68345 ChemSpider
LMFA07010421 LIPID MAPS
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Registry Number Type Source
2639-64-7 CAS Registry Number ChemIDplus