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CHEBI:180383 - 2,2-dimethyl-3-butenoic acid

ChEBI IDCHEBI:180383
ChEBI Name2,2-dimethyl-3-butenoic acid
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC6H10O2
Net Charge0
Average Mass114.144
Monoisotopic Mass114.06808
SMILESC=CC(C)(C)C(=O)O
InChIInChI=1S/C6H10O2/c1-4-6(2,3)5(7)8/h4H,1H2,2-3H3,(H,7,8)
InChIKeySCFWAOWWAANBPY-UHFFFAOYSA-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)
2,2-dimethyl-3-butenoic acid (CHEBI:180383) is a branched-chain fatty acid (CHEBI:35819)
IUPAC Name 
2,2-dimethylbut-3-enoic acid
Manual XrefsDatabases
LMFA01020099LIPID MAPS
122708ChemSpider
Registry NumbersSources
CAS:10276-09-2ChemIDplus