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4,5-DIPHENYL-1,3,4-THIADIAZOLIUM-2-THIOLATE
SpectraBase Compound ID GjMKk8gFtft
InChI InChI=1S/C14H11N2S2/c17-14-15-16(12-9-5-2-6-10-12)13(18-14)11-7-3-1-4-8-11/h1-10H,(H,15,17)
InChIKey IVFFXLVOMTWSNJ-UHFFFAOYSA-N
Mol Weight 271.38 g/mol
Molecular Formula C14H11N2S2
Exact Mass 271.036366 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2piVUNSlbx7
Name 4,5-DIPHENYL-1,3,4-THIADIAZOLIUM-2-THIOLATE
Compound Number MI.1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C14H11N2S2
InChI InChI=1S/C14H11N2S2/c17-14-15-16(12-9-5-2-6-10-12)13(18-14)11-7-3-1-4-8-11/h1-10H,(H,15,17)
InChIKey IVFFXLVOMTWSNJ-UHFFFAOYSA-N
Literature Reference Author P.F.D.ATHAYDE-FILHO,J.MILLER,A.M.SIMAS,K.X.D.F.R.D.SENA,A.D. A.CHIAPPETA
Literature Reference Citation ACTA.FARM.BONA.,18,17(1999)
Molecular Weight 271.375 g/mol
Source File Reference UWBT7219