| SpectraBase Spectrum ID |
FodpZQ3ycxh |
| Name |
Valeramide, N-benzyl-N-octadecyl- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
443.412715330 u |
| Formula |
C30H53NO |
| InChI |
InChI=1S/C30H53NO/c1-3-5-7-8-9-10-11-12-13-14-15-16-17-18-19-23-27-31(30(32)26-6-4-2)28-29-24-21-20-22-25-29/h20-22,24-25H,3-19,23,26-28H2,1-2H3 |
| InChIKey |
ZBNCJRGZPKXIGD-UHFFFAOYSA-N |
| Molecular Weight |
443.760 g/mol |
| SMILES |
C(N(CCCCCCCCCCCCCCCCCC)CC1=CC=CC=C1)(=O)CCCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.910785 |
