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2,4,5-Trinitrobromobenzene
SpectraBase Compound ID LgjR1HnIaeH
InChI InChI=1S/C6H2BrN3O6/c7-3-1-5(9(13)14)6(10(15)16)2-4(3)8(11)12/h1-2H
InChIKey PRNFUYCMLAZMCX-UHFFFAOYSA-N
Mol Weight 292.0 g/mol
Molecular Formula C6H2BrN3O6
Exact Mass 290.912698 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID PhOXtqVF9c
Name 2,4,5-Trinitrobromobenzene
Alternate Name(s) 1-bromo-2,4,5-trinitrobenzene
CAS Registry Number 89464-07-3
Comments Less than 3 mono-isotopic peaks
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Formula C6H2BrN3O6
InChI InChI=1S/C6H2BrN3O6/c7-3-1-5(9(13)14)6(10(15)16)2-4(3)8(11)12/h1-2H
InChIKey PRNFUYCMLAZMCX-UHFFFAOYSA-N
Molecular Weight 292.001 g/mol
SMILES c1(c(N(=O)=O)cc(c(c1)N(=O)=O)Br)N(=O)=O
SPLASH splash10-00di-9030000000-144497e99c78796494ff
Source of Spectrum J-49-4580-0
Wiley ID 1294274