| SpectraBase Spectrum ID |
BkdkgWVSnQX |
| Name |
Benzamide, N,N-bis(2-ethylhexyl)-4-butyl- |
| 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/c1-6-11-14-23(9-4)21-28(22-24(10-5)15-12-7-2)27(29)26-19-17-25(18-20-26)16-13-8-3/h17-20,23-24H,6-16,21-22H2,1-5H3 |
| InChIKey |
UZXKSCLIHROMHE-UHFFFAOYSA-N |
| Molecular Weight |
401.679 g/mol |
| SMILES |
CCCCC1=CC=C(C=C1)C(N(CC(CCCC)CC)CC(CC)CCCC)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.840856 |
