CHEBI:172088 - Hexyl nonanoate

ChEBI IDCHEBI:172088
ChEBI NameHexyl nonanoate
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC15H30O2
Net Charge0
Average Mass242.403
Monoisotopic Mass242.22458
SMILESCCCCCCCCC(=O)OCCCCCC
InChIInChI=1S/C15H30O2/c1-3-5-7-9-10-11-13-15(16)17-14-12-8-6-4-2/h3-14H2,1-2H3
InChIKeyGPHBCFMWKGZPRP-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606)
Pooled sample (NCIT:C45910) MetaboLights (MTBLS2128)
blood plasma (BTO:0000131) MetaboLights (MTBLS2128)
ChEBI Ontology
Outgoing Relation(s)
Hexyl nonanoate (CHEBI:172088) is a fatty acid ester (CHEBI:35748)
IUPAC Name 
hexyl nonanoate
Manual XrefsDatabases
73118ChemSpider
HMDB0032328HMDB
LMFA07010910LIPID MAPS
Registry NumbersSources
CAS:6561-39-3ChemIDplus