| SpectraBase Compound ID | HCIql7E3nBg |
|---|---|
| InChI | InChI=1S/C20H37NO3/c1-6-7-8-9-10-11-12-13-14-24-20(23)19(17(4)5)21-18(22)15-16(2)3/h15,17,19H,6-14H2,1-5H3,(H,21,22) |
| InChIKey | JUSABVAYSUUWME-UHFFFAOYSA-N |
| Mol Weight | 339.5 g/mol |
| Molecular Formula | C20H37NO3 |
| Exact Mass | 339.277344 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GKH9HJY87DO |
|---|---|
| Name | L-Valine, N-(3-methylbut-2-enoyl)-, decyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 339.277344052 u |
| Formula | C20H37NO3 |
| InChI | InChI=1S/C20H37NO3/c1-6-7-8-9-10-11-12-13-14-24-20(23)19(17(4)5)21-18(22)15-16(2)3/h15,17,19H,6-14H2,1-5H3,(H,21,22) |
| InChIKey | JUSABVAYSUUWME-UHFFFAOYSA-N |
| Molecular Weight | 339.520 g/mol |
| SMILES | CCCCCCCCCCOC(C(NC(=O)C=C(C)C)C(C)C)=O |