| SpectraBase Spectrum ID |
1I35ClLnqv8 |
| Name |
Methyl 3,4-diphenyl-2,3-dihydro-1H-2-benzazepine-2-carboxylate |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
355.157228918 u |
| Formula |
C24H21NO2 |
| InChI |
InChI=1S/C24H21NO2/c1-27-24(26)25-17-21-15-9-8-14-20(21)16-22(18-10-4-2-5-11-18)23(25)19-12-6-3-7-13-19/h2-16,23H,17H2,1H3 |
| InChIKey |
GMQYZRADDKIZAV-UHFFFAOYSA-N |
| Molecular Weight |
355.437 g/mol |
| SMILES |
C1(N(CC=2C(C=C1C1=CC=CC=C1)=CC=CC2)C(=O)OC)C=1C=CC=CC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.896252 |
