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4-[(4'-Bromobenzoyl)carbonyl]-5,7-dinitrobenzofurazan
SpectraBase Compound ID 1m2QoRhtKdf
InChI InChI=1S/C14H5BrN4O7/c15-7-3-1-6(2-4-7)13(20)14(21)10-8(18(22)23)5-9(19(24)25)11-12(10)17-26-16-11/h1-5H
InChIKey GRZMWAACWGBAEL-UHFFFAOYSA-N
Mol Weight 421.12 g/mol
Molecular Formula C14H5BrN4O7
Exact Mass 419.934162 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GnwPUh07Wqg
Name 4-[(4'-Bromobenzoyl)carbonyl]-5,7-dinitrobenzofurazan
Alternate Name(s) 1-(4-bromophenyl)-2-(5,7-dinitro-2,1,3-benzoxadiazol-4-yl)-1,2-ethanedione
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Formula C14H5BrN4O7
InChI InChI=1S/C14H5BrN4O7/c15-7-3-1-6(2-4-7)13(20)14(21)10-8(18(22)23)5-9(19(24)25)11-12(10)17-26-16-11/h1-5H
InChIKey GRZMWAACWGBAEL-UHFFFAOYSA-N
Molecular Weight 421.119 g/mol
SMILES c1(c2c(non2)c(cc1N(=O)=O)N(=O)=O)C(C(c1ccc(cc1)Br)=O)=O
SPLASH splash10-001i-0900000000-bc63b937d4cdec24bb11
Source of Spectrum SK-23-1574-4
Wiley ID 865672