| SpectraBase Compound ID | KaoCG4cBcwV |
|---|---|
| InChI | InChI=1S/C11H21NO3/c1-5-6-7-15-11(14)10(8(2)3)12-9(4)13/h8,10H,5-7H2,1-4H3,(H,12,13) |
| InChIKey | JAGRTDYZOKZQIX-UHFFFAOYSA-N |
| Mol Weight | 215.29 g/mol |
| Molecular Formula | C11H21NO3 |
| Exact Mass | 215.152144 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4EqWaw5Du1M |
|---|---|
| Name | N-Acetyl-dl-valine, N-butyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 215.152143537 u |
| Formula | C11H21NO3 |
| InChI | InChI=1S/C11H21NO3/c1-5-6-7-15-11(14)10(8(2)3)12-9(4)13/h8,10H,5-7H2,1-4H3,(H,12,13) |
| InChIKey | JAGRTDYZOKZQIX-UHFFFAOYSA-N |
| Molecular Weight | 215.293 g/mol |
| SMILES | C(C)(C)C(C(OCCCC)=O)NC(=O)C |