| SpectraBase Spectrum ID |
GAStBCtJ9MX |
| Name |
Benzamide, 4-butyl-N-propyl-N-(2-ethylhexyl)- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
331.287514814 u |
| Formula |
C22H37NO |
| InChI |
InChI=1S/C22H37NO/c1-5-9-11-19(8-4)18-23(17-7-3)22(24)21-15-13-20(14-16-21)12-10-6-2/h13-16,19H,5-12,17-18H2,1-4H3 |
| InChIKey |
HSXRJNFGPOAXGF-UHFFFAOYSA-N |
| Molecular Weight |
331.544 g/mol |
| SMILES |
C(C1=CC=C(C=C1)CCCC)(N(CC(CCCC)CC)CCC)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.947407 |
