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2-{ETHYLTHIO-[(2)-H1]-METHYL}-1-(PHENYLSULFONYL)-INDOLE
SpectraBase Compound ID 3qNjTrC5cxb
InChI InChI=1S/C17H17NO2S2/c1-2-21-13-15-12-14-8-6-7-11-17(14)18(15)22(19,20)16-9-4-3-5-10-16/h3-12H,2,13H2,1H3
InChIKey JASDZDQTKZNANE-UHFFFAOYSA-N
Mol Weight 331.45 g/mol
Molecular Formula C17H17NO2S2
Exact Mass 331.070071 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FDVa74fubvF
Name 2-{ETHYLTHIO-[(2)-H1]-METHYL}-1-(PHENYLSULFONYL)-INDOLE
Compound Number 21
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H17NO2S2
InChI InChI=1S/C17H17NO2S2/c1-2-21-13-15-12-14-8-6-7-11-17(14)18(15)22(19,20)16-9-4-3-5-10-16/h3-12H,2,13H2,1H3
InChIKey JASDZDQTKZNANE-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 331.447 g/mol
Solvent CDCl3
Source File Reference UWMZ795