SpectraBase Spectrum ID |
3AFZZU0ennP |
Name |
N-Benzamido-3,3-diphenyl-2,3-dihydroisoindol-1-one |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
404.152477890 u |
Formula |
C27H20N2O2 |
InChI |
InChI=1S/C27H20N2O2/c30-25(20-12-4-1-5-13-20)28-29-26(31)23-18-10-11-19-24(23)27(29,21-14-6-2-7-15-21)22-16-8-3-9-17-22/h1-19H,(H,28,30) |
InChIKey |
QZEOBWVFMUEZAP-UHFFFAOYSA-N |
Molecular Weight |
404.469 g/mol |
SMILES |
C1(N(C(C=2C=CC=CC12)=O)NC(=O)C=1C=CC=CC1)(C1=CC=CC=C1)C=1C=CC=CC1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.944104 |