SpectraBase Spectrum ID |
J0RZueoNTUX |
Name |
2,2-Diphenylazeto[2,1-B]quinazolin-1-one |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
324.126263142 u |
Formula |
C22H16N2O |
InChI |
InChI=1S/C22H16N2O/c25-21-22(17-10-3-1-4-11-17,18-12-5-2-6-13-18)20-23-19-14-8-7-9-16(19)15-24(20)21/h1-14H,15H2 |
InChIKey |
KKNDFJRMDMWULJ-UHFFFAOYSA-N |
Molecular Weight |
324.383 g/mol |
SMILES |
C1=2N(CC3=C(N2)C=CC=C3)C(C1(C=1C=CC=CC1)C1=CC=CC=C1)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.948459 |