SpectraBase Spectrum ID |
3yFrDsaye55 |
Name |
Benzamide, 4-butyl-N-(2-ethylphenyl)- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
281.177964364 u |
Formula |
C19H23NO |
InChI |
InChI=1S/C19H23NO/c1-3-5-8-15-11-13-17(14-12-15)19(21)20-18-10-7-6-9-16(18)4-2/h6-7,9-14H,3-5,8H2,1-2H3,(H,20,21) |
InChIKey |
XPFOCIUGUSFSIN-UHFFFAOYSA-N |
SMILES |
C(C1=CC=C(C=C1)CCCC)(=O)NC=1C(CC)=CC=CC1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.962797 |