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Methyl 3-Amino-4-bromo-5-nitrobenzoate
SpectraBase Compound ID CDck38LvSPy
InChI InChI=1S/C8H7BrN2O4/c1-15-8(12)4-2-5(10)7(9)6(3-4)11(13)14/h2-3H,10H2,1H3
InChIKey NBXYAOPLSVPFKK-UHFFFAOYSA-N
Mol Weight 275.06 g/mol
Molecular Formula C8H7BrN2O4
Exact Mass 273.95892 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CrZ8ViufgIa
Name Methyl 3-Amino-4-bromo-5-nitrobenzoate
Comments Less than 3 mono-isotopic peaks
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Formula C8H7BrN2O4
InChI InChI=1S/C8H7BrN2O4/c1-15-8(12)4-2-5(10)7(9)6(3-4)11(13)14/h2-3H,10H2,1H3
InChIKey NBXYAOPLSVPFKK-UHFFFAOYSA-N
Molecular Weight 275.058 g/mol
SMILES Nc1cc(C(=O)OC)cc(c1Br)N(=O)=O
SPLASH splash10-00fr-0090000000-c9af3737062030e31374
Source of Spectrum F-68-9586-43
Synonyms 3-amino-4-bromo-5-nitro-benzoic acid methyl ester methyl 3-azanyl-4-bromanyl-5-nitro-benzoate 3-amino-4-bromo-5-nitrobenzoic acid methyl ester
Wiley ID 1573840