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4-PHENYL-5-PARA-CHLOROPHENYL-1,3,4-THIADIAZOLIUM-2-THIOLATE
SpectraBase Compound ID IRx3JrwBVK9
InChI InChI=1S/C14H10ClN2S2/c15-11-8-6-10(7-9-11)13-17(16-14(18)19-13)12-4-2-1-3-5-12/h1-9H,(H,16,18)
InChIKey QXHCPGMYRSGMHU-UHFFFAOYSA-N
Mol Weight 305.82 g/mol
Molecular Formula C14H10ClN2S2
Exact Mass 304.997393 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2nikPzmtE0j
Name 4-PHENYL-5-PARA-CHLOROPHENYL-1,3,4-THIADIAZOLIUM-2-THIOLATE
Compound Number MI.2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C14H10ClN2S2
InChI InChI=1S/C14H10ClN2S2/c15-11-8-6-10(7-9-11)13-17(16-14(18)19-13)12-4-2-1-3-5-12/h1-9H,(H,16,18)
InChIKey QXHCPGMYRSGMHU-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 305.820 g/mol
Source File Reference UWBT7220