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(3S)-3-[(4-methylphenyl)sulfonylamino]-4-phenylbutanoic acid methyl ester
SpectraBase Compound ID 3mTOwnd4x0S
InChI InChI=1S/C18H21NO4S/c1-14-8-10-17(11-9-14)24(21,22)19-16(13-18(20)23-2)12-15-6-4-3-5-7-15/h3-11,16,19H,12-13H2,1-2H3/t16-/m0/s1
InChIKey WHJZMUPSIOTWLU-INIZCTEOSA-N
Mol Weight 347.43 g/mol
Molecular Formula C18H21NO4S
Exact Mass 347.119129 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KZPq8L1tihV
Name (3S)-3-[(4-methylphenyl)sulfonylamino]-4-phenylbutanoic acid methyl ester
Alternate Name(s) (3S)-4-phenyl-3-(tosylamino)butyric acid methyl ester Methyl (3S)-4-phenyl-3-(p-tolylsulfonylamino)butanoate Methyl (3S)-3-[(4-methylphenyl)sulfonylamino]-4-phenylbutanoate
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Formula C18H21NO4S
InChI InChI=1S/C18H21NO4S/c1-14-8-10-17(11-9-14)24(21,22)19-16(13-18(20)23-2)12-15-6-4-3-5-7-15/h3-11,16,19H,12-13H2,1-2H3/t16-/m0/s1
InChIKey WHJZMUPSIOTWLU-INIZCTEOSA-N
Molecular Weight 347.429 g/mol
SMILES N(S(c1ccc(cc1)C)(=O)=O)[C@](CC(=O)OC)(Cc1ccccc1)[H]
SPLASH splash10-0a4l-9580000000-a52be599bd80bd60fe4a
Source of Spectrum KC-0-1922-7
Wiley ID 825673