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1-[2-HYDROXY-2-(4-METHYLTHIOPHENYL)]-ETHANOYL-2-PHENYL-PYRROLIDINE;MAJOR-ISOMER
SpectraBase Compound ID EVGBONxJgnJ
InChI InChI=1S/C19H21NO2S/c1-23-16-11-9-15(10-12-16)18(21)19(22)20-13-5-8-17(20)14-6-3-2-4-7-14/h2-4,6-7,9-12,17-18,21H,5,8,13H2,1H3
InChIKey WTYFKFURPNLJSV-UHFFFAOYSA-N
Mol Weight 327.44 g/mol
Molecular Formula C19H21NO2S
Exact Mass 327.1293 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5vbcVHiZQHL
Name 1-[2-HYDROXY-2-(4-METHYLTHIOPHENYL)]-ETHANOYL-2-PHENYL-PYRROLIDINE;MAJOR-ISOMER
Compound Number 7
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C19H21NO2S
InChI InChI=1S/C19H21NO2S/c1-23-16-11-9-15(10-12-16)18(21)19(22)20-13-5-8-17(20)14-6-3-2-4-7-14/h2-4,6-7,9-12,17-18,21H,5,8,13H2,1H3
InChIKey WTYFKFURPNLJSV-UHFFFAOYSA-N
Literature Reference Author O.SCHULZE,U.SCHMIDT,J.VOSS,B.NEBELING,G.ADIWIDJAJA,K.SCHARWA ECHTER
Literature Reference Citation BIOORG.MED.CHEM.,9,2105(2001)
Literature Reference DOI 10.1016/S0968-0896(01)00117-1
Molecular Weight 327.441 g/mol
Solvent CDCl3
Source File Reference UWMS22109