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N-(N-Hippuryl-thio-glycyl)-3-phenyl-L-alanine

View entire compound with spectra: 1 NMR

N-(N-Hippuryl-thio-glycyl)-3-phenyl-L-alanine
SpectraBase Compound ID FnqxULt7adB
InChI InChI=1S/C20H21N3O4S/c24-17(12-22-19(25)15-9-5-2-6-10-15)21-13-18(28)23-16(20(26)27)11-14-7-3-1-4-8-14/h1-10,16H,11-13H2,(H,21,24)(H,22,25)(H,23,28)(H,26,27)
InChIKey PLRSJSDLYJNOKH-UHFFFAOYSA-N
Mol Weight 399.47 g/mol
Molecular Formula C20H21N3O4S
Exact Mass 399.125277 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3ai3U5xIymj
Name N-(N-Hippuryl-thio-glycyl)-3-phenyl-L-alanine
CAS Registry Number 79787-01-2
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C20H21N3O4S
InChI InChI=1S/C20H21N3O4S/c24-17(12-22-19(25)15-9-5-2-6-10-15)21-13-18(28)23-16(20(26)27)11-14-7-3-1-4-8-14/h1-10,16H,11-13H2,(H,21,24)(H,22,25)(H,23,28)(H,26,27)
InChIKey PLRSJSDLYJNOKH-UHFFFAOYSA-N
Instrument Name Varian XL-100
Literature Reference P. Cambell, N.T. Nashed, J. Am. Chem. Soc. 104, 5221 (1982).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent DMSO-D6