SpectraBase Spectrum ID |
Hy1o1wUDvx0 |
Name |
N-Acetyl-3-(1-benzoylmethyl)dihydroisoindoleone |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
293.105193344 u |
Formula |
C18H15NO3 |
InChI |
InChI=1S/C18H15NO3/c1-12(20)19-16(11-17(21)13-7-3-2-4-8-13)14-9-5-6-10-15(14)18(19)22/h2-10,16H,11H2,1H3 |
InChIKey |
OPRYFVZXRRCPMV-UHFFFAOYSA-N |
SMILES |
C1(N(C(C=2C=CC=CC12)CC(=O)C1=CC=CC=C1)C(=O)C)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.964051 |