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N-METHYL-2,6-DI-(PARA-METHYLPHENYL)-3-(PARA-CHLOROPHENYLTHIO)-PIPERIDIN-4-ONE
SpectraBase Compound ID HklNXAi4msL
InChI InChI=1S/C26H26ClNOS/c1-17-4-8-19(9-5-17)23-16-24(29)26(30-22-14-12-21(27)13-15-22)25(28(23)3)20-10-6-18(2)7-11-20/h4-15,23,25-26H,16H2,1-3H3
InChIKey YYILYRPCFGWRMC-UHFFFAOYSA-N
Mol Weight 436.01 g/mol
Molecular Formula C26H26ClNOS
Exact Mass 435.142363 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 80qe6KIZvhh
Name N-METHYL-2,6-DI-(PARA-METHYLPHENYL)-3-(PARA-CHLOROPHENYLTHIO)-PIPERIDIN-4-ONE
Compound Number 1S
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C26H26ClNOS
InChI InChI=1S/C26H26ClNOS/c1-17-4-8-19(9-5-17)23-16-24(29)26(30-22-14-12-21(27)13-15-22)25(28(23)3)20-10-6-18(2)7-11-20/h4-15,23,25-26H,16H2,1-3H3
InChIKey YYILYRPCFGWRMC-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 436.012 g/mol
Sample ID 54929
Solvent CDCl3