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1-METHYL-4-{2-[1-(4-METHOXYPHENYLSULFONYL)-2-INDOLYL]-1,3-DITHIAN-2-YL}-4-PIPERIDINOL
SpectraBase Compound ID DaaToH0qvFq
InChI InChI=1S/C25H30N2O4S3/c1-26-14-12-24(28,13-15-26)25(32-16-5-17-33-25)23-18-19-6-3-4-7-22(19)27(23)34(29,30)21-10-8-20(31-2)9-11-21/h3-4,6-11,18,28H,5,12-17H2,1-2H3
InChIKey ZTDSUNCZILZYNA-UHFFFAOYSA-N
Mol Weight 518.71 g/mol
Molecular Formula C25H30N2O4S3
Exact Mass 518.136771 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9u8VUpEZLW2
Name 1-METHYL-4-{2-[1-(4-METHOXYPHENYLSULFONYL)-2-INDOLYL]-1,3-DITHIAN-2-YL}-4-PIPERIDINOL
Compound Number 7
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C25H30N2O4S3
InChI InChI=1S/C25H30N2O4S3/c1-26-14-12-24(28,13-15-26)25(32-16-5-17-33-25)23-18-19-6-3-4-7-22(19)27(23)34(29,30)21-10-8-20(31-2)9-11-21/h3-4,6-11,18,28H,5,12-17H2,1-2H3
InChIKey ZTDSUNCZILZYNA-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 518.704 g/mol
Solvent CDCl3
Source File Reference UWMZ784