| SpectraBase Compound ID | KkZQfMAg7dV |
|---|---|
| InChI | InChI=1S/C19H36ClNO4/c1-4-5-6-7-8-9-10-11-12-15-24-18(22)17(2)21(3)19(23)25-16-13-14-20/h17H,4-16H2,1-3H3 |
| InChIKey | UXVXITMDJFIHNF-UHFFFAOYSA-N |
| Mol Weight | 378.0 g/mol |
| Molecular Formula | C19H36ClNO4 |
| Exact Mass | 377.233286 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5O6wOnvfJBE |
|---|---|
| Name | dl-Alanine, N-methyl-N-(3-chloropropoxycarbonyl)-, undecyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 377.233286339 u |
| Formula | C19H36ClNO4 |
| InChI | InChI=1S/C19H36ClNO4/c1-4-5-6-7-8-9-10-11-12-15-24-18(22)17(2)21(3)19(23)25-16-13-14-20/h17H,4-16H2,1-3H3 |
| InChIKey | UXVXITMDJFIHNF-UHFFFAOYSA-N |
| Molecular Weight | 377.953 g/mol |
| SMILES | CC(N(C)C(=O)OCCCCl)C(=O)OCCCCCCCCCCC |