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2-(4-NITROPHENYL)-3-METHYL-4-(4-METHYLPHENYL)-1,3-THIAZOLIUM-5-THIOLATE
SpectraBase Compound ID LGAmwOk91C7
InChI InChI=1S/C17H14N2O2S2/c1-11-3-5-12(6-4-11)15-17(22)23-16(18(15)2)13-7-9-14(10-8-13)19(20)21/h3-10H,1-2H3
InChIKey OSFRHQQSFHEDJD-UHFFFAOYSA-N
Mol Weight 342.43 g/mol
Molecular Formula C17H14N2O2S2
Exact Mass 342.04967 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 65kAcgdQubn
Name 2-(4-NITROPHENYL)-3-METHYL-4-(4-METHYLPHENYL)-1,3-THIAZOLIUM-5-THIOLATE
Compound Number MIC-14
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H14N2O2S2
InChI InChI=1S/C17H14N2O2S2/c1-11-3-5-12(6-4-11)15-17(22)23-16(18(15)2)13-7-9-14(10-8-13)19(20)21/h3-10H,1-2H3
InChIKey OSFRHQQSFHEDJD-UHFFFAOYSA-N
Literature Reference Author B.F.LYRA,S.A.D.MORAIS,G.B.ROCHA,J.MILLER,G.L.C.MOURA,A.M.SIM AS,C.PEPPE
Literature Reference Citation J.BRAZ.CHEM.SOC.,21,934(2010)
Literature Reference DOI 10.1590/s0103-50532010000500024
Molecular Weight 342.430 g/mol
Source File Reference UWBT5862