2-Methyl-3-hydroxybutyric acid

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Systematic / IUPAC Name: 3-Hydroxy-2-methylbutanoic acid

ID: Reference197

Other Names: 3-Hydroxy-2-methylbutyric acid;
2-Methyl-3-hydroxybutyrate;
α-Methyl-β-hydroxybutyrate;
Butanoic acid, 3-hydroxy-2-methyl-;
3-Hydroxy-2-methylbutyrate ; more

Formula: C5H10O3

Class: Endogenous Metabolites

Spectral Data

2-Methyl-3-hydroxybutyric acid mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

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Available MS Data

Used Instruments Orbitrap Elite
No. of Spectral Trees 1
No. of Spectra 146
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 11/19/2014 8:09:08 AM
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Identificators

InChI InChI=1S/C5H10O3/c1-3(4(2)6)5(7)8/h3-4,6H,1-2H3,(H,7,8)
InChI Key VEXDRERIMPLZLU-UHFFFAOYSA-N
Canonical SMILES CC(C(C)O)C(=O)O
CAS 473869
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Other Names 3-Hydroxy-2-methylbutyric acid;
2-Methyl-3-hydroxybutyrate;
α-Methyl-β-hydroxybutyrate;
Butanoic acid, 3-hydroxy-2-methyl-;
3-Hydroxy-2-methylbutyrate;
2-Methyl-3-hydroxybutanoic acid;
α-Methyl-β-hydroxybutyric acid;
Nilic acid

In Other Databases

PubChem 160471
ChemIDPlus 000473869
ChemSpider 141015; 21233752; 21238367
ChEBI CHEBI:37051
HMDb HMDB00354