SpectraBase Spectrum ID |
Kt6z5dnO7e6 |
Name |
Benzamide, 4-butyl-N-benzyl-N-decyl- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
407.318814943 u |
Formula |
C28H41NO |
InChI |
InChI=1S/C28H41NO/c1-3-5-7-8-9-10-11-15-23-29(24-26-17-13-12-14-18-26)28(30)27-21-19-25(20-22-27)16-6-4-2/h12-14,17-22H,3-11,15-16,23-24H2,1-2H3 |
InChIKey |
NVCKPWOKTWVOAM-UHFFFAOYSA-N |
Molecular Weight |
407.642 g/mol |
SMILES |
C(N(CCCCCCCCCC)CC1=CC=CC=C1)(=O)C=1C=CC(=CC1)CCCC |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.923406 |