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4,6-Diketo-6a-(3-nitrophenyl)-5-phenyl-1,3a-dihydropyrrolo[3,4-c]pyrazole-3-carboxylic acid methyl ester
SpectraBase Compound ID F4WB9KmWqUq
InChI InChI=1S/C19H14N4O6/c1-29-17(25)15-14-16(24)22(12-7-3-2-4-8-12)18(26)19(14,21-20-15)11-6-5-9-13(10-11)23(27)28/h2-10,14,21H,1H3
InChIKey IHDJIERXLABMQW-UHFFFAOYSA-N
Mol Weight 394.34 g/mol
Molecular Formula C19H14N4O6
Exact Mass 394.091334 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FLadJiUGAd6
Name 4,6-Diketo-6a-(3-nitrophenyl)-5-phenyl-1,3a-dihydropyrrolo[3,4-c]pyrazole-3-carboxylic acid methyl ester
Alternate Name(s) 6a-(3-nitrophenyl)-4,6-dioxo-5-phenyl-1,3a-dihydropyrrolo[3,4-c]pyrazole-3-carboxylic acid methyl ester Methyl 6a-(3-nitrophenyl)-4,6-bis(oxidanylidene)-5-phenyl-1,3a-dihydropyrrolo[3,4-c]pyrazole-3-carboxylate Methyl 6a-(3-nitrophenyl)-4,6-dioxo-5-phenyl-1,3a,4,5,6,6a-hexahydropyrrolo[3,4-c]pyrazole-3-carboxylate Methyl 6a-(3-nitrophenyl)-4,6-dioxo-5-phenyl-1,3a-dihydropyrrolo[3,4-c]pyrazole-3-carboxylate
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Formula C19H14N4O6
InChI InChI=1S/C19H14N4O6/c1-29-17(25)15-14-16(24)22(12-7-3-2-4-8-12)18(26)19(14,21-20-15)11-6-5-9-13(10-11)23(27)28/h2-10,14,21H,1H3
InChIKey IHDJIERXLABMQW-UHFFFAOYSA-N
Molecular Weight 394.343 g/mol
SMILES N1N=C(C2C1(C(N(C2=O)c1ccccc1)=O)c1cc(N(=O)=O)ccc1)C(=O)OC
SPLASH splash10-014i-3941000000-34c6a08d7c224fe920ef
Wiley ID 1453812