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4,5-DIPHENYL-1,3,4-THIADIAZOLIUM-2-PHENYLAMINE-CHLORIDE
SpectraBase Compound ID IKyPzdSWfLm
InChI InChI=1S/C20H16N3S.ClH/c1-4-10-16(11-5-1)19-23(18-14-8-3-9-15-18)22-20(24-19)21-17-12-6-2-7-13-17;/h1-15H,(H,21,22);1H/q+1;/p-1
InChIKey PJTBQWQYYUXRQA-UHFFFAOYSA-M
Mol Weight 365.88 g/mol
Molecular Formula C20H16ClN3S
Exact Mass 365.075346 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7UULMM8M2z9
Name 4,5-DIPHENYL-1,3,4-THIADIAZOLIUM-2-PHENYLAMINE-CHLORIDE
Compound Number 4A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H16ClN3S
InChI InChI=1S/C20H16N3S.ClH/c1-4-10-16(11-5-1)19-23(18-14-8-3-9-15-18)22-20(24-19)21-17-12-6-2-7-13-17;/h1-15H,(H,21,22);1H/q+1;/p-1
InChIKey PJTBQWQYYUXRQA-UHFFFAOYSA-M
Literature Reference Author M.A.M.MACIEL,A.ECHEVARRIA,V.M.RUMJANEK
Literature Reference Citation QUIM.NOVA,21,569(1998)
Literature Reference DOI 10.1590/s0100-40421998000500007
Molecular Weight 365.880 g/mol
Solvent DMSO-D6
Source File Reference UWBT12465