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L-3-(benzylthio)-N-(p-toluenesulfonyl)alanine

View entire compound with spectra: 1 NMR, 1 FTIR, and 1 UV-Vis

L-3-(benzylthio)-N-(p-toluenesulfonyl)alanine
SpectraBase Compound ID 58rc31rAC3u
InChI InChI=1S/C17H19NO4S2/c1-13-7-9-15(10-8-13)24(21,22)18-16(17(19)20)12-23-11-14-5-3-2-4-6-14/h2-10,16,18H,11-12H2,1H3,(H,19,20)
InChIKey MKQPPJXESXECOF-UHFFFAOYSA-N
Mol Weight 365.46 g/mol
Molecular Formula C17H19NO4S2
Exact Mass 365.07555 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 9ZMh8zbyHtY
Name L-3-(BENZYLTHIO)-N-(p-TOLYLSULFONYL)ALANINE
Source of Sample Aldrich Chemical Company, Inc., Milwaukee, Wisconsin
Comments Tentative assignment
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17N19NO4S2
InChI InChI=1S/C17H19NO4S2/c1-13-7-9-15(10-8-13)24(21,22)18-16(17(19)20)12-23-11-14-5-3-2-4-6-14/h2-10,16,18H,11-12H2,1H3,(H,19,20)
InChIKey MKQPPJXESXECOF-UHFFFAOYSA-N
Molecular Weight 505.54
Solvent Polysol; Reference=TMS Spectrometer= Varian CFT-20
Synonyms ALANINE, 3-/BENZYLTHIO/-N- /P-TOLUENESULFONYL/-, L-,