| SpectraBase Compound ID | b7TgM0oxmg |
|---|---|
| InChI | InChI=1S/C18H34ClNO4/c1-2-3-4-5-6-7-8-9-10-11-15-23-17(21)12-14-20-18(22)24-16-13-19/h2-16H2,1H3,(H,20,22) |
| InChIKey | JNDZGVLNMFAXSN-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 | Gi4y5Gc9JLE |
|---|---|
| Name | .beta.-Alanine, N-(2-chloroethoxycarbonyl)-, dodecyl 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/c1-2-3-4-5-6-7-8-9-10-11-15-23-17(21)12-14-20-18(22)24-16-13-19/h2-16H2,1H3,(H,20,22) |
| InChIKey | JNDZGVLNMFAXSN-UHFFFAOYSA-N |
| Molecular Weight | 363.926 g/mol |
| SMILES | CCCCCCCCCCCCOC(CCNC(OCCCl)=O)=O |