| SpectraBase Compound ID | LRGIKfhHOyJ |
|---|---|
| InChI | InChI=1S/C18H34ClNO4/c1-4-5-6-7-8-9-10-11-14-23-17(21)16(2)20(3)18(22)24-15-12-13-19/h16H,4-15H2,1-3H3 |
| InChIKey | SNBHOYQCOKANKM-UHFFFAOYSA-N |
| Mol Weight | 363.9 g/mol |
| Molecular Formula | C18H34ClNO4 |
| Exact Mass | 363.217636 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9WG4tauEHu8 |
|---|---|
| Name | dl-Alanine, N-methyl-N-(3-chloropropoxycarbonyl)-, decyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 363.217636275 u |
| Formula | C18H34ClNO4 |
| InChI | InChI=1S/C18H34ClNO4/c1-4-5-6-7-8-9-10-11-14-23-17(21)16(2)20(3)18(22)24-15-12-13-19/h16H,4-15H2,1-3H3 |
| InChIKey | SNBHOYQCOKANKM-UHFFFAOYSA-N |
| Molecular Weight | 363.926 g/mol |
| SMILES | CC(N(C)C(=O)OCCCCl)C(=O)OCCCCCCCCCC |