| SpectraBase Spectrum ID |
8TsbS9WdWhg |
| Name |
Hexanamide, 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 |
487.338878362 u |
| Formula |
C27H54BrNO |
| InChI |
InChI=1S/C27H54BrNO/c1-5-8-10-11-12-13-14-15-16-17-18-19-20-21-24-29(25(4)22-7-3)27(30)26(28)23-9-6-2/h25-26H,5-24H2,1-4H3 |
| InChIKey |
WOCOFKLMRXHGKP-UHFFFAOYSA-N |
| Molecular Weight |
488.639 g/mol |
| SMILES |
C(N(C(CCC)C)C(=O)C(CCCC)Br)CCCCCCCCCCCCCCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.921576 |
