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(S)-3-(4-Methylbenzenesulfonamido)-4-phenylbutan-1-al
SpectraBase Compound ID Apr28H8poGn
InChI InChI=1S/C17H19NO3S/c1-14-7-9-17(10-8-14)22(20,21)18-16(11-12-19)13-15-5-3-2-4-6-15/h2-10,12,16,18H,11,13H2,1H3/t16-/m1/s1
InChIKey PGPZGZIUHWZLRT-MRXNPFEDSA-N
Mol Weight 317.4 g/mol
Molecular Formula C17H19NO3S
Exact Mass 317.108565 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID eXwmbrEmIb
Name (S)-3-(4-Methylbenzenesulfonamido)-4-phenylbutan-1-al
Alternate Name(s) N-[(1S)-1-benzyl-3-oxopropyl]-4-methylbenzenesulfonamide 4-Methyl-N-[(2S)-4-oxo-1-phenylbutan-2-yl]benzenesulfonamide N-[(1S)-1-benzyl-3-oxo-propyl]-4-methyl-benzenesulfonamide 4-Methyl-N-[(2S)-4-oxidanylidene-1-phenyl-butan-2-yl]benzenesulfonamide
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Formula C17H19NO3S
InChI InChI=1S/C17H19NO3S/c1-14-7-9-17(10-8-14)22(20,21)18-16(11-12-19)13-15-5-3-2-4-6-15/h2-10,12,16,18H,11,13H2,1H3/t16-/m1/s1
InChIKey PGPZGZIUHWZLRT-MRXNPFEDSA-N
Molecular Weight 317.403 g/mol
SMILES N(S(c1ccc(cc1)C)(=O)=O)[C@@](Cc1ccccc1)(CC=O)[H]
SPLASH splash10-054o-9540000000-b009dea9f37edd637f0b
Source of Spectrum KC-0-2443-25
Wiley ID 784279