| SpectraBase Compound ID | GIwbpY7YBR2 |
|---|---|
| InChI | InChI=1S/C8H17NO2/c1-6(2)7(9(3)4)8(10)11-5/h6-7H,1-5H3 |
| InChIKey | WCLAWMHDRSCPOK-UHFFFAOYSA-N |
| Mol Weight | 159.23 g/mol |
| Molecular Formula | C8H17NO2 |
| Exact Mass | 159.125929 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7DOwF34TwAh |
|---|---|
| Name | L-Valine, N,N-dimethyl-, methyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 159.125928789 u |
| Formula | C8H17NO2 |
| InChI | InChI=1S/C8H17NO2/c1-6(2)7(9(3)4)8(10)11-5/h6-7H,1-5H3 |
| InChIKey | WCLAWMHDRSCPOK-UHFFFAOYSA-N |
| Molecular Weight | 159.229 g/mol |
| SMILES | C(C(C(OC)=O)N(C)C)(C)C |