![6H-Pyridazino[1,6-a]quinazolin-6-one](/api/spectrum/Jhe1ddqPyTk/structure.png?h=300&w=458 "6H-Pyridazino[1,6-a]quinazolin-6-one")
| SpectraBase Compound ID | 4knIX3AStyM |
|---|---|
| InChI | InChI=1S/C11H7N3O/c15-11-8-4-1-2-5-9(8)14-10(13-11)6-3-7-12-14/h1-7H |
| InChIKey | CXBAOVAYAZJSMT-UHFFFAOYSA-N |
| Mol Weight | 197.2 g/mol |
| Molecular Formula | C11H7N3O |
| Exact Mass | 197.058912 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | Jhe1ddqPyTk |
|---|---|
| Name | 6H-Pyridazino[1,6-A]quinazolin-6-one |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 197.058911856 u |
| Formula | C11H7N3O |
| InChI | InChI=1S/C11H7N3O/c15-11-8-4-1-2-5-9(8)14-10(13-11)6-3-7-12-14/h1-7H |
| InChIKey | CXBAOVAYAZJSMT-UHFFFAOYSA-N |
| Molecular Weight | 197.197 g/mol |
| SMILES | C1=CC=C2C(C(N=C3N2N=CC=C3)=O)=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.913199 |