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1,5-Diamino-4,8-bis(2-nitrobenzamido)anthraquinone
SpectraBase Compound ID 8ifnqhunaKj
InChI InChI=1S/C28H18N6O8/c29-15-9-11-17(31-27(37)13-5-1-3-7-19(13)33(39)40)23-21(15)26(36)24-18(12-10-16(30)22(24)25(23)35)32-28(38)14-6-2-4-8-20(14)34(41)42/h1-12H,29-30H2,(H,31,37)(H,32,38)
InChIKey RBFTVHUJHFPDHR-UHFFFAOYSA-N
Mol Weight 566.49 g/mol
Molecular Formula C28H18N6O8
Exact Mass 566.118612 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GgZdmL0aeRv
Name 1,5-Diamino-4,8-bis(2-nitrobenzamido)anthraquinone
Alternate Name(s) N-(4,8-Diamino-5-[(2-nitrobenzoyl)amino]-9,10-dioxo-9,10-dihydro-1-anthracenyl)-2-nitrobenzamide N-[4,8-bis(azanyl)-5-[(2-nitrophenyl)carbonylamino]-9,10-bis(oxidanylidene)anthracen-1-yl]-2-nitro-benzamide N-[4,8-diamino-5-[(2-nitrobenzoyl)amino]-9,10-dioxo-1-anthryl]-2-nitro-benzamide N-[4,8-diamino-5-[(2-nitrobenzoyl)amino]-9,10-dioxoanthracen-1-yl]-2-nitrobenzamide N-[4,8-diamino-5-[[(2-nitrophenyl)-oxomethyl]amino]-9,10-dioxo-1-anthracenyl]-2-nitrobenzamide N-[4,8-diamino-9,10-diketo-5-[(2-nitrobenzoyl)amino]-1-anthryl]-2-nitro-benzamide
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Formula C28H18N6O8
InChI InChI=1S/C28H18N6O8/c29-15-9-11-17(31-27(37)13-5-1-3-7-19(13)33(39)40)23-21(15)26(36)24-18(12-10-16(30)22(24)25(23)35)32-28(38)14-6-2-4-8-20(14)34(41)42/h1-12H,29-30H2,(H,31,37)(H,32,38)
InChIKey RBFTVHUJHFPDHR-UHFFFAOYSA-N
Molecular Weight 566.486 g/mol
SMILES Nc1ccc(c2C(c3c(ccc(c3C(c12)=O)NC(=O)c1ccccc1N(=O)=O)N)=O)NC(=O)c1ccccc1N(=O)=O
SPLASH splash10-0udi-9510000000-df4a6c41c33a587429ff
Wiley ID 1469408