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CHEBI:179559 - ethyl 4-methyl-heptanoate

ChEBI IDCHEBI:179559
ChEBI Nameethyl 4-methyl-heptanoate
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SubmitterMetaboLights
DownloadsMolfile
FormulaC10H20O2
Net Charge0
Average Mass172.268
Monoisotopic Mass172.14633
SMILESCCCC(C)CCC(=O)OCC
InChIInChI=1S/C10H20O2/c1-4-6-9(3)7-8-10(11)12-5-2/h9H,4-8H2,1-3H3
InChIKeyNYSADWJQUICPEE-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
ethyl 4-methyl-heptanoate (CHEBI:179559) is a fatty acid ester (CHEBI:35748)
IUPAC Name 
ethyl 4-methylheptanoate
Manual XrefsDatabases
8948848ChemSpider
LMFA07010518LIPID MAPS