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1-methyl-2-(methylthio)pyridin-1-ium-3-carboxylic acid iodide
SpectraBase Compound ID KHZnHQP3f74
InChI InChI=1S/C8H9NO2S.HI/c1-9-5-3-4-6(8(10)11)7(9)12-2;/h3-5H,1-2H3;1H
InChIKey HULASSUYBSHZTK-UHFFFAOYSA-N
Mol Weight 311.14 g/mol
Molecular Formula C8H10INO2S
Exact Mass 310.947695 g/mol

15N Nuclear Magnetic Resonance (NMR) Chemical Shifts

15N Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Kixja2JwCYC
Name 1-methyl-2-(methylthio)pyridin-1-ium-3-carboxylic acid iodide
Compound Number 7
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C8H10INO2S
InChI InChI=1S/C8H9NO2S.HI/c1-9-5-3-4-6(8(10)11)7(9)12-2;/h3-5H,1-2H3;1H
InChIKey HULASSUYBSHZTK-UHFFFAOYSA-N
Literature Reference Author L.STEFANIAK,G.A.WEBB,C.BREVARD,M.BOURDONNEAU,R.LEJEUNE,L.THU NUS,C.L.LAPIERE
Literature Reference Citation MAGN.RES.CHEM.,23,790(1985)
Literature Reference DOI 10.1002/mrc.1260230923
Solvent DMSO
Source File Reference UWRH765