SpectraBase Spectrum ID |
9yjtvQaeSk6 |
Name |
Benzamide, 4-butyl-N-butyl-N-2-ethylhexyl- |
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/c1-5-9-12-20(8-4)19-24(18-11-7-3)23(25)22-16-14-21(15-17-22)13-10-6-2/h14-17,20H,5-13,18-19H2,1-4H3 |
InChIKey |
WEQLBBOBVUWVSA-UHFFFAOYSA-N |
Molecular Weight |
345.571 g/mol |
SMILES |
C1=C(C=CC(=C1)CCCC)C(N(CC(CCCC)CC)CCCC)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.947314 |