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2-(4-CHLOROPHENYL)-3-N-METHYL-4-PHENYL-1,3-THIAZOLIUM-5-METHYLTHIO-IODIDE
SpectraBase Compound ID Hcovb5kysi2
InChI InChI=1S/C17H15ClNS2.HI/c1-19-15(12-6-4-3-5-7-12)17(20-2)21-16(19)13-8-10-14(18)11-9-13;/h3-11H,1-2H3;1H/q+1;/p-1
InChIKey WSPCEHAAVPMFFX-UHFFFAOYSA-M
Mol Weight 459.79 g/mol
Molecular Formula C17H15ClINS2
Exact Mass 458.937915 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CryK5i22xsN
Name 2-(4-CHLOROPHENYL)-3-N-METHYL-4-PHENYL-1,3-THIAZOLIUM-5-METHYLTHIO-IODIDE
Compound Number 5A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H15ClINS2
InChI InChI=1S/C17H15ClNS2.HI/c1-19-15(12-6-4-3-5-7-12)17(20-2)21-16(19)13-8-10-14(18)11-9-13;/h3-11H,1-2H3;1H/q+1;/p-1
InChIKey WSPCEHAAVPMFFX-UHFFFAOYSA-M
Literature Reference Author J.A.S.LUIS,T.M.DEAQUINO,B.F.LIRA,P.F.A.FILHO,M.T.SCOTTI,L.SC OTTI,R.O.DEMOURA,F.J
Literature Reference Citation ACTA.PHARM.,64,233(2014)
Molecular Weight 459.790 g/mol
Solvent CDCl3
Source File Reference UWLU78922