D-ALLOISOLEUCINE
Compound with spectra: 1 NMR, and 1 MS (GC)
| SpectraBase Compound ID | IqIHMBKkVqp |
|---|---|
| InChI | InChI=1S/C6H13NO2/c1-3-4(2)5(7)6(8)9/h4-5H,3,7H2,1-2H3,(H,8,9)/t4-,5?/m0/s1 |
| InChIKey | AGPKZVBTJJNPAG-ROLXFIACSA-N |
| Mol Weight | 131.17 g/mol |
| Molecular Formula | C6H13NO2 |
| Exact Mass | 131.094629 g/mol |
| Enantiomer InChIKey | AGPKZVBTJJNPAG-CNZKWPKMSA-N |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
|---|---|
| Source of Spectrum | KC-0-1972-17 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
|---|---|
| Solvent | H2O:D2O=95:5 |
- (3S)-2-amino-3-methyl-pentanoic acid
| Title | Journal or Book | Year |
|---|---|---|
| Empirical equations for predicting 13C chemical shifts in nuclear magnetic resonance spectra of certain types of amino acids | Canadian Journal of Chemistry | 1976 |
This compound is available in the following databases:
KnowItAll NMR Spectral Library
Author: Wiley
The KnowItAll NMR Spectral Library offers a comprehensive collection of NMR reference spectra, including NMR, CNMR, and XNMR, and covers a wide range of compounds including organics, polymers, monomers, metabolites, and more. Learn more.