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(2S)-2-(4-Toluenesulfonamido)-3-phenyl-propionic acid

View entire compound with spectra: 2 NMR, and 1 MS (GC)

(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

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3TmYPGYj7jU
Name (2S)-2-(4-Toluenesulfonamido)-3-phenyl-propionic acid
CAS Registry Number 13505-32-3
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
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
Instrument Name Varian XL-200
Literature Reference S.G. Pyne, M.J. Hensel, P.L.Fuchs, J. Am. Chem. Soc. 104, 5719 (1982).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent Acetone-D6