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(2S)-2-(4-Toluenesulfonamido)-3-phenyl-propionic acid
SpectraBase Compound ID B7TKfKcgCim
InChI InChI=1S/C16H17NO4S/c1-12-7-9-14(10-8-12)22(20,21)17-15(16(18)19)11-13-5-3-2-4-6-13/h2-10,15,17H,11H2,1H3,(H,18,19)
InChIKey CGRCVIZBNRUWLY-UHFFFAOYSA-N
Mol Weight 319.38 g/mol
Molecular Formula C16H17NO4S
Exact Mass 319.087829 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3XE07lzj1zF
Name 2-[(4-methylbenzene)sulfonamido]-3-phenylpropanoic acid
Alternate Name(s) 2-[(4-methylphenyl)sulfonylamino]-3-phenylpropanoic acid 3-Phenyl-2-(p-tolylsulfonylamino)propanoic acid 2-[(4-methylphenyl)sulfonylamino]-3-phenyl-propanoic acid
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Formula C16H17NO4S
InChI InChI=1S/C16H17NO4S/c1-12-7-9-14(10-8-12)22(20,21)17-15(16(18)19)11-13-5-3-2-4-6-13/h2-10,15,17H,11H2,1H3,(H,18,19)
InChIKey CGRCVIZBNRUWLY-UHFFFAOYSA-N
Molecular Weight 319.375 g/mol
SMILES N(S(c1ccc(cc1)C)(=O)=O)C(C(=O)O)Cc1ccccc1
SPLASH splash10-052f-9810000000-119e6199156831a29aaf
Source of Spectrum IY-2-5094-7
Wiley ID 1658930