| SpectraBase Compound ID | 9R3xDgZxhpg |
|---|---|
| InChI | InChI=1S/C9H18N2O3.H2O/c1-5(2)4-7(10)8(12)11-6(3)9(13)14;/h5-7H,4,10H2,1-3H3,(H,11,12)(H,13,14);1H2/t6-,7-;/m0./s1 |
| InChIKey | FTDFAGANYJVHDA-LEUCUCNGSA-N |
| Mol Weight | 218.25 g/mol |
| Molecular Formula | C9H18N2O4 |
| Exact Mass | 218.126657 g/mol |
13C Nuclear Magnetic Resonance (NMR) Spectrum
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| SpectraBase Spectrum ID | 6fYOk3hvC5c |
|---|---|
| Name | Leu-Ala hydrate |
| Source of Sample | Sigma-Aldrich Co. LLC. |
| Catalog Number | 851256 |
| CAS Registry Number | 7298-84-2 |
| Copyright | Copyright © 2021-2025 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C9H18N2O4 |
| InChI | 1S/C9H18N2O3.H2O/c1-5(2)4-7(10)8(12)11-6(3)9(13)14;/h5-7H,4,10H2,1-3H3,(H,11,12)(H,13,14);1H2/t6-,7-;/m0./s1 |
| InChIKey | FTDFAGANYJVHDA-LEUCUCNGSA-N |
| Observed nucleus | 13C |
| Purity | 99% |
| Solvent | D2O |
| Source of Spectrum | Sigma-Aldrich Co. LLC. |
| Synonyms | L-Leucyl-L-alanine hydrate |
| Wiley ID | SIAL_13CNMR_010425 |