| SpectraBase Spectrum ID |
aUsB0k9BwI |
| Name |
Benzamide, 3-bromo-N-propyl-N-hexadecyl- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
465.260628040 u |
| Formula |
C26H44BrNO |
| InChI |
InChI=1S/C26H44BrNO/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 |
WNQCSUZXPJZNTC-UHFFFAOYSA-N |
| Molecular Weight |
466.548 g/mol |
| SMILES |
C1=C(C=C(C=C1)C(N(CCCCCCCCCCCCCCCC)CCC)=O)Br |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.817982 |
