SpectraBase Spectrum ID |
1qUYabVV7KB |
Name |
Benzamide, 4-ethyl-N-(2-butyl)-N-tetradecyl- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
401.365765136 u |
Formula |
C27H47NO |
InChI |
InChI=1S/C27H47NO/c1-5-8-9-10-11-12-13-14-15-16-17-18-23-28(24(4)6-2)27(29)26-21-19-25(7-3)20-22-26/h19-22,24H,5-18,23H2,1-4H3 |
InChIKey |
LHLBLMUEHVEWCM-UHFFFAOYSA-N |
Molecular Weight |
401.679 g/mol |
SMILES |
C(N(CCCCCCCCCCCCCC)C(CC)C)(=O)C=1C=CC(=CC1)CC |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.854496 |