| SpectraBase Spectrum ID |
J63jMb5b0Ui |
| Name |
3,9-Dioxo-3,9-dihydro-2H-indeno[2,1-C]pyridazine-4-carbonitrile |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
223.038176411 u |
| Formula |
C12H5N3O2 |
| InChI |
InChI=1S/C12H5N3O2/c13-5-8-9-6-3-1-2-4-7(6)11(16)10(9)14-15-12(8)17/h1-4H,(H,15,17) |
| InChIKey |
WCHMDHWVBQULEJ-UHFFFAOYSA-N |
| Molecular Weight |
223.191 g/mol |
| SMILES |
C1=2C(=NNC(C2C#N)=O)C(=O)C=2C1=CC=CC2 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.907869 |
![3,9-Dioxo-3,9-dihydro-2H-indeno[2,1-c]pyridazine-4-carbonitrile](/api/spectrum/J63jMb5b0Ui/structure.png?h=300&w=458 "3,9-Dioxo-3,9-dihydro-2H-indeno[2,1-c]pyridazine-4-carbonitrile")
