| SpectraBase Compound ID | 4y5VihS6pmP |
|---|---|
| InChI | InChI=1S/C23H46ClNO2/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-21-25(20-4-2)23(26)27-22-18-19-24/h3-22H2,1-2H3 |
| InChIKey | ZOVRAWBPIJOTJZ-UHFFFAOYSA-N |
| Mol Weight | 404.1 g/mol |
| Molecular Formula | C23H46ClNO2 |
| Exact Mass | 403.321707 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6mpSrK5Bwvq |
|---|---|
| Name | Carbonic acid, monoamide, N-propyl-N-hexadecyl-, 3-chloropropyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 403.321707423 u |
| Formula | C23H46ClNO2 |
| InChI | InChI=1S/C23H46ClNO2/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-21-25(20-4-2)23(26)27-22-18-19-24/h3-22H2,1-2H3 |
| InChIKey | ZOVRAWBPIJOTJZ-UHFFFAOYSA-N |
| Molecular Weight | 404.079 g/mol |
| SMILES | C(=O)(OCCCCl)N(CCC)CCCCCCCCCCCCCCCC |