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2-Amino-3-bromo-5-methylbenzoic acid
SpectraBase Compound ID 19K58APJRgB
InChI InChI=1S/C8H8BrNO2/c1-4-2-5(8(11)12)7(10)6(9)3-4/h2-3H,10H2,1H3,(H,11,12)
InChIKey LCMZECCEEOQWLQ-UHFFFAOYSA-N
Mol Weight 230.06 g/mol
Molecular Formula C8H8BrNO2
Exact Mass 228.973841 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4CBnRud2E07
Name 2-Amino-3-bromo-5-methylbenzoic acid
CAS Registry Number 13091-43-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H8BrNO2
InChI InChI=1S/C8H8BrNO2/c1-4-2-5(8(11)12)7(10)6(9)3-4/h2-3H,10H2,1H3,(H,11,12)
InChIKey LCMZECCEEOQWLQ-UHFFFAOYSA-N
Molecular Weight 230.061 g/mol
SMILES Nc1c(C(=O)O)cc(cc1Br)C
SPLASH splash10-03gi-1290000000-5b16eb77641f840339a8
Source of Spectrum F-56-8741-15
Synonyms 2-Azanyl-3-bromanyl-5-methyl-benzoic acid
Wiley ID 859127