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N-(4-METHYLPHENYL)-SULFONYL-T(3)-ISOPROPYL-R(2),C(6)-BIS-(PARA-CHLOROPHENYL)-PIPERIDIN-4-ONE
SpectraBase Compound ID Ii07KiuP6MX
InChI InChI=1S/C27H27Cl2NO3S/c1-17(2)26-25(31)16-24(19-6-10-21(28)11-7-19)30(27(26)20-8-12-22(29)13-9-20)34(32,33)23-14-4-18(3)5-15-23/h4-15,17,24,26-27H,16H2,1-3H3/t24-,26+,27-/m0/s1
InChIKey LEOGPBPGCAHQDQ-OIKPOIBNSA-N
Mol Weight 516.48 g/mol
Molecular Formula C27H27Cl2NO3S
Exact Mass 515.10887 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Hh9e7SISg4z
Name N-(4-METHYLPHENYL)-SULFONYL-T(3)-ISOPROPYL-R(2),C(6)-BIS-(PARA-CHLOROPHENYL)-PIPERIDIN-4-ONE
Compound Number 7
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H27Cl2NO3S
InChI InChI=1S/C27H27Cl2NO3S/c1-17(2)26-25(31)16-24(19-6-10-21(28)11-7-19)30(27(26)20-8-12-22(29)13-9-20)34(32,33)23-14-4-18(3)5-15-23/h4-15,17,24,26-27H,16H2,1-3H3/t24-,26+,27-/m0/s1
InChIKey LEOGPBPGCAHQDQ-OIKPOIBNSA-N
Literature Reference Author A.MANIMEKALAO,S.SIVAKUMAR
Literature Reference Citation MAGN.RES.CHEM.,49,830(2011)
Molecular Weight 516.482 g/mol
Solvent DMSO-D6
Source File Reference UWBT13146