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2-(2-BROMO-ACETYLAMINO)-BENZOIC-ACID
SpectraBase Compound ID LuJ7ZbLEdNo
InChI InChI=1S/C9H8BrNO3/c10-5-8(12)11-7-4-2-1-3-6(7)9(13)14/h1-4H,5H2,(H,11,12)(H,13,14)
InChIKey QZWSCOXXIITFGQ-UHFFFAOYSA-N
Mol Weight 258.07 g/mol
Molecular Formula C9H8BrNO3
Exact Mass 256.968756 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LNwCpTdcxtb
Name 2-(2-bromanylethanoylamino)benzoic acid
Alternate Name(s) 2-[(2-bromo-1-oxoethyl)amino]benzoic acid 2-[(2-bromoacetyl)amino]benzoic acid
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Formula C9H8BrNO3
InChI InChI=1S/C9H8BrNO3/c10-5-8(12)11-7-4-2-1-3-6(7)9(13)14/h1-4H,5H2,(H,11,12)(H,13,14)
InChIKey QZWSCOXXIITFGQ-UHFFFAOYSA-N
Molecular Weight 258.071 g/mol
SMILES N(c1c(C(=O)O)cccc1)C(=O)CBr
SPLASH splash10-0a4l-0390000000-5b25350f9e8e421022cb
Source of Spectrum AJ-43-173-1
Wiley ID 1593854