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1,4-DIPHENYL-5-PARA-CHLOROPHENYL-1,3,4-TRIAZOLIUM-2-THIOL-CHLORIDE
SpectraBase Compound ID 31w6lMR2PIM
InChI InChI=1S/C20H14ClN3S.ClH/c21-16-13-11-15(12-14-16)19-23(17-7-3-1-4-8-17)20(25)22-24(19)18-9-5-2-6-10-18;/h1-14H;1H
InChIKey ZEEPHNNPCFZNEX-UHFFFAOYSA-N
Mol Weight 400.33 g/mol
Molecular Formula C20H15Cl2N3S
Exact Mass 399.036374 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Ig64JbDUnoI
Name 1,4-DIPHENYL-5-PARA-CHLOROPHENYL-1,3,4-TRIAZOLIUM-2-THIOL-CHLORIDE
Compound Number MI.5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H15Cl2N3S
InChI InChI=1S/C20H14ClN3S.ClH/c21-16-13-11-15(12-14-16)19-23(17-7-3-1-4-8-17)20(25)22-24(19)18-9-5-2-6-10-18;/h1-14H;1H
InChIKey ZEEPHNNPCFZNEX-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 400.325 g/mol
Source File Reference UWBT7223