| SpectraBase Spectrum ID |
FCvAwY7so4X |
| Name |
4-Butyl-N-(4-butylbenzoyl)-N-(4-methoxyphenyl)benzamide |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
443.246043924 u |
| Formula |
C29H33NO3 |
| InChI |
InChI=1S/C29H33NO3/c1-4-6-8-22-10-14-24(15-11-22)28(31)30(26-18-20-27(33-3)21-19-26)29(32)25-16-12-23(13-17-25)9-7-5-2/h10-21H,4-9H2,1-3H3 |
| InChIKey |
COTXDTNZDIKECS-UHFFFAOYSA-N |
| Molecular Weight |
443.587 g/mol |
| SMILES |
C1(N(C(C=2C=CC(=CC2)CCCC)=O)C(C2=CC=C(C=C2)CCCC)=O)=CC=C(C=C1)OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.830135 |
