| SpectraBase Compound ID | Dyl4KPxRhpM |
|---|---|
| InChI | InChI=1S/C21H39NO4/c1-6-8-9-10-11-12-13-14-15-16-17-26-20(23)19(18(3)4)22(5)21(24)25-7-2/h7,18-19H,2,6,8-17H2,1,3-5H3 |
| InChIKey | WGDKZYPYFSBECB-UHFFFAOYSA-N |
| Mol Weight | 369.5 g/mol |
| Molecular Formula | C21H39NO4 |
| Exact Mass | 369.287909 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5sqqoLaFYFb |
|---|---|
| Name | dl-Valine, N-methyl-N-(vinyloxycarbonyl)-, dodecyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 369.287908736 u |
| Formula | C21H39NO4 |
| InChI | InChI=1S/C21H39NO4/c1-6-8-9-10-11-12-13-14-15-16-17-26-20(23)19(18(3)4)22(5)21(24)25-7-2/h7,18-19H,2,6,8-17H2,1,3-5H3 |
| InChIKey | WGDKZYPYFSBECB-UHFFFAOYSA-N |
| Molecular Weight | 369.546 g/mol |
| SMILES | C(C(C(OCCCCCCCCCCCC)=O)N(C)C(=O)OC=C)(C)C |