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4-[1,1-BIS-(ETHYLTHIO)-1-(1-PHENYLSULFONYL-2-INDOLYL)-METHYL]-1-METHYL-4-PIPERIDINOL
SpectraBase Compound ID 7bgh7YLT7ly
InChI InChI=1S/C25H32N2O3S3/c1-4-31-25(32-5-2,24(28)15-17-26(3)18-16-24)23-19-20-11-9-10-14-22(20)27(23)33(29,30)21-12-7-6-8-13-21/h6-14,19,28H,4-5,15-18H2,1-3H3
InChIKey GPDXVFJWBQVIIR-UHFFFAOYSA-N
Mol Weight 504.7 g/mol
Molecular Formula C25H32N2O3S3
Exact Mass 504.157506 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ILag05YJG7D
Name 4-[1,1-BIS-(ETHYLTHIO)-1-(1-PHENYLSULFONYL-2-INDOLYL)-METHYL]-1-METHYL-4-PIPERIDINOL
Compound Number 19
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C25H32N2O3S3
InChI InChI=1S/C25H32N2O3S3/c1-4-31-25(32-5-2,24(28)15-17-26(3)18-16-24)23-19-20-11-9-10-14-22(20)27(23)33(29,30)21-12-7-6-8-13-21/h6-14,19,28H,4-5,15-18H2,1-3H3
InChIKey GPDXVFJWBQVIIR-UHFFFAOYSA-N
Literature Reference Author M.RUBIRALTA,A.DIEZ,I.REIG,J.CASTELLS,J.L.BETTIOL,D.S.GRIERSO N,H.P.HUSSON
Literature Reference Citation HETEROCYCLES,31,173(1990)
Literature Reference DOI 10.3987/COM-89-5240
Molecular Weight 504.721 g/mol
Solvent CDCl3
Source File Reference UWMZ793