| SpectraBase Spectrum ID |
AVsg78vUegJ |
| Name |
Benzamide, 2-bromo-N-(2-pentyl)-N-hexadecyl- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
493.291928169 u |
| Formula |
C28H48BrNO |
| InChI |
InChI=1S/C28H48BrNO/c1-4-6-7-8-9-10-11-12-13-14-15-16-17-20-24-30(25(3)21-5-2)28(31)26-22-18-19-23-27(26)29/h18-19,22-23,25H,4-17,20-21,24H2,1-3H3 |
| InChIKey |
CWLUGDFAWZKKRL-UHFFFAOYSA-N |
| Molecular Weight |
494.602 g/mol |
| SMILES |
C(N(C(CCC)C)C(=O)C=1C(Br)=CC=CC1)CCCCCCCCCCCCCCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.818889 |
