| SpectraBase Spectrum ID |
LWpesW9MzG9 |
| Name |
1-Benzoylamidomethyl-6-(3-nitrophenyl)-2-phenylbenzene |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
408.147392509 u |
| Formula |
C26H20N2O3 |
| InChI |
InChI=1S/C26H20N2O3/c29-26(20-11-5-2-6-12-20)27-18-25-23(19-9-3-1-4-10-19)15-8-16-24(25)21-13-7-14-22(17-21)28(30)31/h1-17H,18H2,(H,27,29) |
| InChIKey |
AVSCADOHGQUYCO-UHFFFAOYSA-N |
| Molecular Weight |
408.457 g/mol |
| SMILES |
C=1(N(=O)=O)C=C(C=2C(=C(C=3C=CC=CC3)C=CC2)CNC(=O)C2=CC=CC=C2)C=CC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.844671 |
