| SpectraBase Spectrum ID |
AU4NlQ7E0bD |
| Name |
1H-1-Benzazepine, benzeneacetamide deriv. |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
382.168127954 u |
| Formula |
C25H22N2O2 |
| InChI |
InChI=1S/C25H22N2O2/c28-24(16-19-11-5-2-6-12-19)26-23-17-20(15-18-9-3-1-4-10-18)21-13-7-8-14-22(21)27-25(23)29/h1-14,17,23H,15-16H2,(H,26,28)(H,27,29) |
| InChIKey |
XORFDFKKGDWEAS-UHFFFAOYSA-N |
| Molecular Weight |
382.463 g/mol |
| SMILES |
C1(=CC(C(=O)NC=2C1=CC=CC2)NC(=O)CC=1C=CC=CC1)CC1=CC=CC=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.918048 |
