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1,2-benzenedicarbonitrile, 4-nitro-5-(1-oxo-4-phenyl-2(1H)-phthalazinyl)-
SpectraBase Compound ID 59IlTNPQBde
InChI InChI=1S/C22H11N5O3/c23-12-15-10-19(20(27(29)30)11-16(15)13-24)26-22(28)18-9-5-4-8-17(18)21(25-26)14-6-2-1-3-7-14/h1-11H
InChIKey LGECWNOMCXSHHM-UHFFFAOYSA-N
Mol Weight 393.36 g/mol
Molecular Formula C22H11N5O3
Exact Mass 393.086189 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ld2r607WDon
Name 4-(1-keto-4-phenyl-phthalazin-2-yl)-5-nitro-phthalonitrile
Alternate Name(s) 4-Nitro-5-(1-oxidanylidene-4-phenyl-phthalazin-2-yl)benzene-1,2-dicarbonitrile 4-Nitro-5-(1-oxo-4-phenyl-2-phthalazinyl)benzene-1,2-dicarbonitrile 4-Nitro-5-(1-oxo-4-phenyl-phthalazin-2-yl)phthalonitrile 4-Nitro-5-(1-oxo-4-phenylphthalazin-2-yl)benzene-1,2-dicarbonitrile
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Formula C22H11N5O3
InChI InChI=1S/C22H11N5O3/c23-12-15-10-19(20(27(29)30)11-16(15)13-24)26-22(28)18-9-5-4-8-17(18)21(25-26)14-6-2-1-3-7-14/h1-11H
InChIKey LGECWNOMCXSHHM-UHFFFAOYSA-N
Molecular Weight 393.362 g/mol
SMILES c1ccc(C2=NN(c3c(N(=O)=O)cc(c(c3)C#N)C#N)C(c3c2cccc3)=O)cc1
SPLASH splash10-002b-9604000000-d4f26021b3b668ba1e38
Wiley ID 1451132