| SpectraBase Compound ID | KUIexh1f0yV |
|---|---|
| InChI | InChI=1S/C20H37NO3/c1-4-5-6-7-8-9-10-11-12-13-16-24-20(23)14-15-21-19(22)17-18(2)3/h17H,4-16H2,1-3H3,(H,21,22) |
| InChIKey | VTDIKYPZGKKGBZ-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 | AsftPRyxZd9 |
|---|---|
| Name | .beta.-Alanine, N-(3-methylbut-2-enoyl)-, dodecyl 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/c1-4-5-6-7-8-9-10-11-12-13-16-24-20(23)14-15-21-19(22)17-18(2)3/h17H,4-16H2,1-3H3,(H,21,22) |
| InChIKey | VTDIKYPZGKKGBZ-UHFFFAOYSA-N |
| Molecular Weight | 339.520 g/mol |
| SMILES | CC(=CC(NCCC(OCCCCCCCCCCCC)=O)=O)C |