| SpectraBase Spectrum ID |
H9wOTmCFeP7 |
| Name |
4-Benzoyl-2-benzyl-1-oxo-1,2-dihydroisoquinoline |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
339.125928789 u |
| Formula |
C23H17NO2 |
| InChI |
InChI=1S/C23H17NO2/c25-22(18-11-5-2-6-12-18)21-16-24(15-17-9-3-1-4-10-17)23(26)20-14-8-7-13-19(20)21/h1-14,16H,15H2 |
| InChIKey |
MIDBNYXWJDOLMV-UHFFFAOYSA-N |
| Molecular Weight |
339.394 g/mol |
| SMILES |
C1(N(C=C(C=2C=CC=CC12)C(C=1C=CC=CC1)=O)CC=1C=CC=CC1)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.886867 |
