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3,9-Dioxo-3,9-dihydro-2H-indeno[2,1-c]pyridazine-4-carbonitrile
SpectraBase Compound ID 3YY8Tu6oQ6U
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
Mol Weight 223.19 g/mol
Molecular Formula C12H5N3O2
Exact Mass 223.038176 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3JMzVuoSpb5
Name 3,9-Dioxo-3,9-dihydro-2H-indeno[2,1-c]pyridazine-4-carbonitrile
Alternate Name(s) 3,9-bis(oxidanylidene)-2H-indeno[2,1-c]pyridazine-4-carbonitrile 3,9-Diketo-2H-indeno[2,1-c]pyridazine-4-carbonitrile 3,9-Dioxo-2H-indeno[2,1-c]pyridazine-4-carbonitrile
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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 N1N=C2C(=C(C1=O)C#N)c1c(C2=O)cccc1
SPLASH splash10-00ri-8920000000-5db146ee1c658c4065af
Wiley ID 1458682