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4-BENZYL-5-PHENYL-1,4-THIAZIN-2-ONE

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4-BENZYL-5-PHENYL-1,4-THIAZIN-2-ONE
SpectraBase Compound ID G5uIgw4TAbS
InChI InChI=1S/C34H32N2O2S2/c37-32-22-35(30(23-39-32)26-14-6-2-7-15-26)21-28-18-10-11-19-29(28)33-34(38)40-24-31(27-16-8-3-9-17-27)36(33)20-25-12-4-1-5-13-25/h1-19,30-31,33H,20-24H2
InChIKey KVOJKNKXUBQYLW-UHFFFAOYSA-N
Mol Weight 564.8 g/mol
Molecular Formula C34H32N2O2S2
Exact Mass 564.190521 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Hnvo25sSvdh
Name 4-BENZYL-5-PHENYL-1,4-THIAZIN-2-ONE
Compound Number 10
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C34H32N2O2S2
InChI InChI=1S/C34H32N2O2S2/c37-32-22-35(30(23-39-32)26-14-6-2-7-15-26)21-28-18-10-11-19-29(28)33-34(38)40-24-31(27-16-8-3-9-17-27)36(33)20-25-12-4-1-5-13-25/h1-19,30-31,33H,20-24H2
InChIKey KVOJKNKXUBQYLW-UHFFFAOYSA-N
Literature Reference Author K.KHUMTAVEEPORN,H.ALPER
Literature Reference Citation J.AM.CHEM.SOC.,116,5662(1994)
Literature Reference DOI 10.1021/ja00092a016
Molecular Weight 564.760 g/mol
Solvent CDCl3
Source File Reference UWRU10851