| SpectraBase Spectrum ID |
Btb9u2O60YU |
| Name |
Benzamide, 3-chloro-N-propyl-N-hexadecyl- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
421.311142740 u |
| Formula |
C26H44ClNO |
| InChI |
InChI=1S/C26H44ClNO/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-22-28(21-4-2)26(29)24-19-18-20-25(27)23-24/h18-20,23H,3-17,21-22H2,1-2H3 |
| InChIKey |
YDXJBJGJDATBQR-UHFFFAOYSA-N |
| Molecular Weight |
422.097 g/mol |
| SMILES |
C(N(CCC)CCCCCCCCCCCCCCCC)(=O)C=1C=CC=C(Cl)C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.806754 |
