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CHEBI:196146 - 4-Methylphenyl octanoate

ChEBI IDCHEBI:196146
ChEBI Name4-Methylphenyl octanoate
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SubmitterMetaboLights
DownloadsMolfile
FormulaC15H22O2
Net Charge0
Average Mass234.339
Monoisotopic Mass234.16198
SMILESCCCCCCCC(=O)Oc1ccc(C)cc1
InChIInChI=1S/C15H22O2/c1-3-4-5-6-7-8-15(16)17-14-11-9-13(2)10-12-14/h9-12H,3-8H2,1-2H3
InChIKeyALRYNTSLFYRKGF-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
4-Methylphenyl octanoate (CHEBI:196146) is a benzoate ester (CHEBI:36054)
4-Methylphenyl octanoate (CHEBI:196146) is a phenols (CHEBI:33853)
IUPAC Name 
(4-methylphenyl) octanoate
Manual XrefsDatabases
HMDB0037710HMDB
D89360KEGG DRUG
39230ChemSpider