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4-Bromo-3-nitrobenzoic acid
SpectraBase Compound ID 9hX4IHcVyLE
InChI InChI=1S/C7H4BrNO4/c8-5-2-1-4(7(10)11)3-6(5)9(12)13/h1-3H,(H,10,11)
InChIKey RVCTZJVBWNFYRU-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 20ouIdYWkX6
Name 4-Bromo-3-nitrobenzoic acid
Alternate Name(s) Benzoic acid, 4-bromo-3-nitro 4-Bromo-3-nitro-benzoic acid
CAS Registry Number 6319-40-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H4BrNO4
InChI InChI=1S/C7H4BrNO4/c8-5-2-1-4(7(10)11)3-6(5)9(12)13/h1-3H,(H,10,11)
InChIKey RVCTZJVBWNFYRU-UHFFFAOYSA-N
Molecular Weight 246.016 g/mol
SMILES OC(c1ccc(c(c1)N(=O)=O)Br)=O
SPLASH splash10-000j-9000000000-426e6ee7e77c9e5f87af
Source of Spectrum CM-1999-3047-0
Wiley ID 465401