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CHEBI:179470 - 2-methyl-2E-hexenoic acid

ChEBI IDCHEBI:179470
ChEBI Name2-methyl-2E-hexenoic acid
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC7H12O2
Net Charge0
Average Mass128.171
Monoisotopic Mass128.08373
SMILESCCC/C=C(\C)C(=O)O
InChIInChI=1S/C7H12O2/c1-3-4-5-6(2)7(8)9/h5H,3-4H2,1-2H3,(H,8,9)/b6-5+
InChIKeyAKOVMBAFZSPEQU-AATRIKPKSA-N
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
2-methyl-2E-hexenoic acid (CHEBI:179470) is a medium-chain fatty acid (CHEBI:59554)
IUPAC Name 
(E)-2-methylhex-2-enoic acid
Manual XrefsDatabases
LMFA01020101LIPID MAPS
4445777ChemSpider
Registry NumbersSources
CAS:28897-58-7ChemIDplus