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3-Amino-4-methyl-2-nitrobenzoic acid hydrobromide
SpectraBase Compound ID 3w9aLpDJw36
InChI InChI=1S/C8H8N2O4.BrH/c1-4-2-3-5(8(11)12)7(6(4)9)10(13)14;/h2-3H,9H2,1H3,(H,11,12);1H
InChIKey UQPNDIQUXMCNPL-UHFFFAOYSA-N
Mol Weight 277.07 g/mol
Molecular Formula C8H9BrN2O4
Exact Mass 275.97457 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3aPjX157Ds
Name 3-Amino-4-methyl-2-nitrobenzoic acid hydrobromide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H9BrN2O4
InChI InChI=1S/C8H8N2O4.BrH/c1-4-2-3-5(8(11)12)7(6(4)9)10(13)14;/h2-3H,9H2,1H3,(H,11,12);1H
InChIKey UQPNDIQUXMCNPL-UHFFFAOYSA-N
Molecular Weight 277.074 g/mol
SMILES [Br-].OC(c1c(c(c(cc1)C)[NH3+])N(=O)=O)=O
SPLASH splash10-001i-9100000000-b6bde59ca128d4cb3d8b
Source of Spectrum F-56-8744-39
Synonyms 3-Ammonium-4-methyl-2-nitrobenzoic acid bromide
Wiley ID 859109