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JAEXYIAXFPZAAX-UHFFFAOYSA-N
SpectraBase Compound ID 64eO4K7WL3L
InChI InChI=1S/C15H9BrN4O2/c16-7-1-2-8-9(4-18-10(8)3-7)12-13(11-5-17-6-19-11)15(22)20-14(12)21/h1-6,18H,(H,17,19)(H,20,21,22)
InChIKey JAEXYIAXFPZAAX-UHFFFAOYSA-N
Mol Weight 357.17 g/mol
Molecular Formula C15H9BrN4O2
Exact Mass 355.990889 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LEAC7p7ssmD
Name 3-(6-bromanyl-1H-indol-3-yl)-4-(1H-imidazol-5-yl)pyrrole-2,5-dione
Alternate Name(s) 3-(6-bromo-1H-indol-3-yl)-4-(1H-imidazol-5-yl)-1H-pyrrole-2,5-dione 3-(6-bromo-1H-indol-3-yl)-4-(1H-imidazol-5-yl)-3-pyrroline-2,5-quinone 3-(6-bromo-1H-indol-3-yl)-4-(1H-imidazol-5-yl)pyrrole-2,5-dione
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Formula C15H9BrN4O2
InChI InChI=1S/C15H9BrN4O2/c16-7-1-2-8-9(4-18-10(8)3-7)12-13(11-5-17-6-19-11)15(22)20-14(12)21/h1-6,18H,(H,17,19)(H,20,21,22)
InChIKey JAEXYIAXFPZAAX-UHFFFAOYSA-N
Molecular Weight 357.167 g/mol
SMILES N1C(C(=C(c2c[nH]c3c2ccc(c3)Br)C1=O)c1[nH]cnc1)=O
SPLASH splash10-0a6r-0596000000-419581ada35df5393df9
Source of Spectrum J-62-1485-2
Wiley ID 1345529