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2-Bromo-3-nitrobenzoic acid
SpectraBase Compound ID GWRISxkU87E
InChI InChI=1S/C7H4BrNO4/c8-6-4(7(10)11)2-1-3-5(6)9(12)13/h1-3H,(H,10,11)
InChIKey WTDJEGSXLFHZPY-UHFFFAOYSA-N
Mol Weight 246.02 g/mol
Molecular Formula C7H4BrNO4
Exact Mass 244.932371 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IgnM26MLY
Name 2-Bromo-3-nitrobenzoic acid
Appearance Colourless needles
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H4BrNO4
InChI InChI=1S/C7H4BrNO4/c8-6-4(7(10)11)2-1-3-5(6)9(12)13/h1-3H,(H,10,11)
InChIKey WTDJEGSXLFHZPY-UHFFFAOYSA-N
Instrument Name VG Micromass 7070F or JEOL JMS-AX505HF
Ionization Type EI
Literature Reference DOI 10.3998/ark.5550190.0005.a15
Molecular Weight 246.016 g/mol
SMILES OC(c1c(Br)c(ccc1)[N+](=O)[O-])=O
SPLASH splash10-0005-9260000000-7fecbed6177c7890bef5
Source of Spectrum ARK-2004-162-8
Wiley ID 1875851