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2-(4-NITROPHENYL)-3-METHYL-4-(4-METHOXYPHENYL)-1,3-THIAZOLIUM-5-THIOLATE
SpectraBase Compound ID HSUtexmsLQO
InChI InChI=1S/C17H14N2O3S2/c1-18-15(11-5-9-14(22-2)10-6-11)17(23)24-16(18)12-3-7-13(8-4-12)19(20)21/h3-10H,1-2H3
InChIKey GFINSSRZRSBVLU-UHFFFAOYSA-N
Mol Weight 358.43 g/mol
Molecular Formula C17H14N2O3S2
Exact Mass 358.044585 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AXAFOCvMKdo
Name 2-(4-NITROPHENYL)-3-METHYL-4-(4-METHOXYPHENYL)-1,3-THIAZOLIUM-5-THIOLATE
Compound Number MIC-16
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H14N2O3S2
InChI InChI=1S/C17H14N2O3S2/c1-18-15(11-5-9-14(22-2)10-6-11)17(23)24-16(18)12-3-7-13(8-4-12)19(20)21/h3-10H,1-2H3
InChIKey GFINSSRZRSBVLU-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 358.430 g/mol
Source File Reference UWBT5863