SpectraBase Spectrum ID |
7Xgij5vCpNc |
Name |
Valeramide, N-octadecyl- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
353.365765136 u |
Formula |
C23H47NO |
InChI |
InChI=1S/C23H47NO/c1-3-5-7-8-9-10-11-12-13-14-15-16-17-18-19-20-22-24-23(25)21-6-4-2/h3-22H2,1-2H3,(H,24,25) |
InChIKey |
MNWPOMPDIGIBMB-UHFFFAOYSA-N |
Molecular Weight |
353.635 g/mol |
SMILES |
CCCCC(NCCCCCCCCCCCCCCCCCC)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.94274 |