| SpectraBase Spectrum ID |
8zbtWaZbXPW |
| Name |
2-Benzyl-4-phenyl-3A,4,9,9A-tetrahydro-2H-benzo[F]isoindole-1,3-dione |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
367.157228918 u |
| Formula |
C25H21NO2 |
| InChI |
InChI=1S/C25H21NO2/c27-24-21-15-19-13-7-8-14-20(19)22(18-11-5-2-6-12-18)23(21)25(28)26(24)16-17-9-3-1-4-10-17/h1-14,21-23H,15-16H2 |
| InChIKey |
JXVJNRKRGOLDLX-UHFFFAOYSA-N |
| Molecular Weight |
367.448 g/mol |
| SMILES |
C=1C=C(CN2C(C3C(C4=C(CC3C2=O)C=CC=C4)C2=CC=CC=C2)=O)C=CC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.959584 |
![2-Benzyl-4-phenyl-3a,4,9,9a-tetrahydro-2H-benzo[f]isoindole-1,3-dione](/api/spectrum/8zbtWaZbXPW/structure.png?h=300&w=458 "2-Benzyl-4-phenyl-3a,4,9,9a-tetrahydro-2H-benzo[f]isoindole-1,3-dione")
