2-Hydroxyisobutyric acid
13877
Reference
2-Hydroxyisobutyric acid Structure
Systematic / IUPAC Name: 2-Hydroxy-2-methylpropanoic acid
ID: Reference13877
Other Names:
2-Methyllactic acid;
AA-4464
Formula: C4H8O3
Class: Endogenous Metabolites
Spectral Data
2-Hydroxyisobutyric acid mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.
Available MS Data
| Used Instruments | Orbitrap ID-X with ETD_Cal Gateshead |
| No. of Spectral Trees | 1 |
| No. of Spectra | 105 |
| Tandem Spectra | MS1, MS2 |
| Ionization Methods | NSI |
| Analyzers | FT |
| Last Modification | 4/17/2026 8:11:16 AM |
Identificators
| InChI | InChI=1S/C4H8O3/c1-4(2,7)3(5)6/h7H,1-2H3,(H,5,6) |
| InChI Key | BWLBGMIXKSTLSX-UHFFFAOYSA-N |
| Canonical SMILES | CC(C)(O)C(=O)O |
| CAS | |
| Splash | |
| Other Names |
2-Methyllactic acid; AA-4464 |
In Other Databases
| LipidsMAPs | LMFA01050417 |
| ChemSpider | 11181 |
| ChEBI | CHEBI:50129 |
| HMDb | HMDB0000729; HMDB0000729; HMDB0000729; HMDB00729 |
| KEGG | C21297 |
| PubChem | 11671; 11671 |
| ChEMBL | CHEMBL1345148 |