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5-Chloro-2-(isobutyrylamino)benzoic acid
SpectraBase Compound ID 2PMKq7437QP
InChI InChI=1S/C11H12ClNO3/c1-6(2)10(14)13-9-4-3-7(12)5-8(9)11(15)16/h3-6H,1-2H3,(H,13,14)(H,15,16)
InChIKey OEVILGFILDPPFV-UHFFFAOYSA-N
Mol Weight 241.67 g/mol
Molecular Formula C11H12ClNO3
Exact Mass 241.050571 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Gw4CzG6l4fu
Name 5-Chloro-2-(isobutyrylamino)benzoic acid
Alternate Name(s) 5-Chloro-2-[(2-methyl-1-oxopropyl)amino]benzoic acid 5-Chloro-2-(2-methylpropanoylamino)benzoic acid
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Formula C11H12ClNO3
InChI InChI=1S/C11H12ClNO3/c1-6(2)10(14)13-9-4-3-7(12)5-8(9)11(15)16/h3-6H,1-2H3,(H,13,14)(H,15,16)
InChIKey OEVILGFILDPPFV-UHFFFAOYSA-N
Molecular Weight 241.674 g/mol
SMILES N(c1c(C(=O)O)cc(cc1)Cl)C(=O)C(C)C
SPLASH splash10-006x-8910000000-1b50404295c2a577d443
Source of Spectrum IY-3-203-0
Wiley ID 1718151