SpectraBase Spectrum ID |
AYueoRaOgaj |
Name |
7-Methyl-3-phenylquinazolin-4(3H)-one |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
236.094963013 u |
Formula |
C15H12N2O |
InChI |
InChI=1S/C15H12N2O/c1-11-7-8-13-14(9-11)16-10-17(15(13)18)12-5-3-2-4-6-12/h2-10H,1H3 |
InChIKey |
AFWHPZQHNFBKSB-UHFFFAOYSA-N |
Molecular Weight |
236.274 g/mol |
SMILES |
C1=C(C=C2N=CN(C(=O)C2=C1)C1=CC=CC=C1)C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.864009 |