SpectraBase Spectrum ID |
C1Zrzwv6hL7 |
Name |
Valeramide, N-benzyl-N-undecyl- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
345.303164879 u |
Formula |
C23H39NO |
InChI |
InChI=1S/C23H39NO/c1-3-5-7-8-9-10-11-12-16-20-24(23(25)19-6-4-2)21-22-17-14-13-15-18-22/h13-15,17-18H,3-12,16,19-21H2,1-2H3 |
InChIKey |
FYFJHPNQKLGFRT-UHFFFAOYSA-N |
Molecular Weight |
345.571 g/mol |
SMILES |
C(N(CCCCCCCCCCC)CC1=CC=CC=C1)(=O)CCCC |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.921996 |