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2,6-DI-(PARA-METHYLPHENYL)-3-(PARA-CHLOROPHENYLTHIO)-PIPERIDIN-4-ONE
SpectraBase Compound ID Kbm9thrBtBk
InChI InChI=1S/C25H24ClNOS/c1-16-3-7-18(8-4-16)22-15-23(28)25(29-21-13-11-20(26)12-14-21)24(27-22)19-9-5-17(2)6-10-19/h3-14,22,24-25,27H,15H2,1-2H3
InChIKey BZDPJUWMODMZMX-UHFFFAOYSA-N
Mol Weight 421.99 g/mol
Molecular Formula C25H24ClNOS
Exact Mass 421.126713 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8cApHJuSyYX
Name 2,6-DI-(PARA-METHYLPHENYL)-3-(PARA-CHLOROPHENYLTHIO)-PIPERIDIN-4-ONE
Compound Number 1H
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C25H24ClNOS
InChI InChI=1S/C25H24ClNOS/c1-16-3-7-18(8-4-16)22-15-23(28)25(29-21-13-11-20(26)12-14-21)24(27-22)19-9-5-17(2)6-10-19/h3-14,22,24-25,27H,15H2,1-2H3
InChIKey BZDPJUWMODMZMX-UHFFFAOYSA-N
Literature Reference Author M.SRINIVASAN,S.PERUMAL,S.SELVARAJ
Literature Reference Citation CHEM.PHARM.BULL.,54,795(2006)
Literature Reference DOI 10.1248/cpb.54.795
Molecular Weight 421.985 g/mol
Sample ID 54918
Solvent CDCl3