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(2S)-2-(N-Benzyl-4-toluenesulfonamido)-3-phenyl-propionic acid, benzyl ester
SpectraBase Compound ID KNn0978kJng
InChI InChI=1S/C30H29NO4S/c1-24-17-19-28(20-18-24)36(33,34)31(22-26-13-7-3-8-14-26)29(21-25-11-5-2-6-12-25)30(32)35-23-27-15-9-4-10-16-27/h2-20,29H,21-23H2,1H3
InChIKey TUKJLPILEHSXGP-UHFFFAOYSA-N
Mol Weight 499.63 g/mol
Molecular Formula C30H29NO4S
Exact Mass 499.18173 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID II9v6HzYtPD
Name (2S)-2-(N-Benzyl-4-toluenesulfonamido)-3-phenyl-propionic acid, benzyl ester
CAS Registry Number 82495-71-4
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C30H29NO4S
InChI InChI=1S/C30H29NO4S/c1-24-17-19-28(20-18-24)36(33,34)31(22-26-13-7-3-8-14-26)29(21-25-11-5-2-6-12-25)30(32)35-23-27-15-9-4-10-16-27/h2-20,29H,21-23H2,1H3
InChIKey TUKJLPILEHSXGP-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 CDCl3