CHEBI:180006 - 2-ethyl-2-methyl-butanoic acid

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ChEBI Name 2-ethyl-2-methyl-butanoic acid
ChEBI ID CHEBI:180006
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
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Formula C7H14O2
Net Charge 0
Average Mass 130.187
Monoisotopic Mass 130.09938
InChI InChI=1S/C7H14O2/c1-4-7(3,5-2)6(8)9/h4-5H2,1-3H3,(H,8,9)
InChIKey LHJPKLWGGMAUAN-UHFFFAOYSA-N
SMILES OC(=O)C(CC)(CC)C
Roles Classification
Chemical Role(s): Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
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ChEBI Ontology
Outgoing 2-ethyl-2-methyl-butanoic acid (CHEBI:180006) is a methyl-branched fatty acid (CHEBI:62499)
IUPAC Name
2-ethyl-2-methylbutanoic acid
Manual Xrefs Databases
27733 ChemSpider
LMFA01020146 LIPID MAPS
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Registry Number Type Source
19889-37-3 CAS Registry Number ChemIDplus