| SpectraBase Spectrum ID |
LrvBtkkuThr |
| Name |
2-(4'-Chlorophenyl)-6'-chloroquinazolino[4,3-B]quinazolin-5-one |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
391.027917385 u |
| Formula |
C21H11Cl2N3O |
| InChI |
InChI=1S/C21H11Cl2N3O/c22-13-7-5-12(6-8-13)19-24-17-4-2-1-3-15(17)20-25-18-10-9-14(23)11-16(18)21(27)26(19)20/h1-11H |
| InChIKey |
LUPLAJMPWPWVGY-UHFFFAOYSA-N |
| Molecular Weight |
392.245 g/mol |
| SMILES |
C1=2N(C(C3=C(N2)C=CC(=C3)Cl)=O)C(=NC2=CC=CC=C12)C1=CC=C(C=C1)Cl |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.846849 |
![2-(4'-Chlorophenyl)-6'-chloroquinazolino[4,3-b]quinazolin-5-one](/api/spectrum/LrvBtkkuThr/structure.png?h=300&w=458 "2-(4'-Chlorophenyl)-6'-chloroquinazolino[4,3-b]quinazolin-5-one")
