2-Hydroxy-2-methylbutyric acid

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

ID: Reference152

Other Names: Butanoic acid, 2-hydroxy-2-methyl-;
2-Hydroxy-2-methyl butyric acid;
2-Hydroxy-2-methyl-butanoic acid;
2-Hydroxy-2-methyl-n-butyric acid;
2-Hydroxy-2-methylbutyrate ; more

Formula: C5H10O3

Class: Endogenous Metabolites

Spectral Data

2-Hydroxy-2-methylbutyric 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 10/10/2016 12:38:43 PM
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Identificators

InChI InChI=1S/C5H10O3/c1-3-5(2,8)4(6)7/h8H,3H2,1-2H3,(H,6,7)
InChI Key MBIQENSCDNJOIY-UHFFFAOYSA-N
Canonical SMILES CCC(C)(C(=O)O)O
CAS 3739308
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Other Names Butanoic acid, 2-hydroxy-2-methyl-;
2-Hydroxy-2-methyl butyric acid;
2-Hydroxy-2-methyl-butanoic acid;
2-Hydroxy-2-methyl-n-butyric acid;
2-Hydroxy-2-methylbutyrate;
2-Hydroxy-2-methyl-butanoate;
2-Hydroxy-2-methyl-n-butyrate;
Butyric acid, 2-hydroxy-2-methyl-

In Other Databases

HMDb HMDB01987
PubChem 95433
ChEBI CHEBI:68454
ChemSpider 86129
ChemIDPlus 003739308