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2-(2-METHYL-1,3-DITHIAN-2-YL)-1-(4-METHOXYPHENYLSULFONYL)-INDOLE
SpectraBase Compound ID LiuMDYrDvAF
InChI InChI=1S/C20H21NO3S3/c1-20(25-12-5-13-26-20)19-14-15-6-3-4-7-18(15)21(19)27(22,23)17-10-8-16(24-2)9-11-17/h3-4,6-11,14H,5,12-13H2,1-2H3
InChIKey ZAKTXWHSYDJRAG-UHFFFAOYSA-N
Mol Weight 419.57 g/mol
Molecular Formula C20H21NO3S3
Exact Mass 419.068357 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3Nnm3QJIMiB
Name 2-(2-METHYL-1,3-DITHIAN-2-YL)-1-(4-METHOXYPHENYLSULFONYL)-INDOLE
Compound Number 6
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H21NO3S3
InChI InChI=1S/C20H21NO3S3/c1-20(25-12-5-13-26-20)19-14-15-6-3-4-7-18(15)21(19)27(22,23)17-10-8-16(24-2)9-11-17/h3-4,6-11,14H,5,12-13H2,1-2H3
InChIKey ZAKTXWHSYDJRAG-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 419.572 g/mol
Solvent CDCl3
Source File Reference UWMZ783