Systematic / IUPAC Name: 3-Amino-4-methylpentanoic acid
ID: Reference414
Other Names:
Pentanoic acid, 3-amino-4-methyl-;
β-Leucine;
DL-β-Homovaline;
DL-Homo-β-valine
Formula: C6H13NO2
Class: Endogenous Metabolites
DL-β-Leucine mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.
| Used Instruments | Orbitrap Elite |
| No. of Spectral Trees | 2 |
| No. of Spectra | 221 |
| Tandem Spectra | MS1, MS2 |
| Ionization Methods | ESI |
| Analyzers | FT |
| Last Modification | 1/16/2015 10:35:33 AM |
| InChI | InChI=1S/C6H13NO2/c1-4(2)5(7)3-6(8)9/h4-5H,3,7H2,1-2H3,(H,8,9) |
| InChI Key | GLUJNGJDHCTUJY-UHFFFAOYSA-N |
| Canonical SMILES | CC(C)C(CC(=O)O)N |
| CAS | 5699547 |
| Splash | |
| Other Names |
Pentanoic acid, 3-amino-4-methyl-; β-Leucine; DL-β-Homovaline; DL-Homo-β-valine |