| SpectraBase Spectrum ID |
2Dw2K0j2d4i |
| Name |
Hexanamide, 2-bromo-N-(2-pentyl)-N-octadecyl- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
515.370178491 u |
| Formula |
C29H58BrNO |
| InChI |
InChI=1S/C29H58BrNO/c1-5-8-10-11-12-13-14-15-16-17-18-19-20-21-22-23-26-31(27(4)24-7-3)29(32)28(30)25-9-6-2/h27-28H,5-26H2,1-4H3 |
| InChIKey |
ULJOJTHJTBVHGW-UHFFFAOYSA-N |
| Molecular Weight |
516.693 g/mol |
| SMILES |
C(N(C(CCC)C)C(=O)C(CCCC)Br)CCCCCCCCCCCCCCCCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.93724 |
