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N-METHYL-[METHYL-(PHENYLSULFONYL)]-PYRIDINIUM-IODIDE
SpectraBase Compound ID 89uuyQ7Lsii
InChI InChI=1S/C13H14NO2S.HI/c1-14-9-5-6-12(10-14)11-17(15,16)13-7-3-2-4-8-13;/h2-10H,11H2,1H3;1H/q+1;/p-1
InChIKey GESLCQBQDYBRLK-UHFFFAOYSA-M
Mol Weight 375.22 g/mol
Molecular Formula C13H14INO2S
Exact Mass 374.978995 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1luM7sfLsQV
Name N-METHYL-[METHYL-(PHENYLSULFONYL)]-PYRIDINIUM-IODIDE
CAS Registry Number 1620-40-2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H14INO2S
InChI InChI=1S/C13H14NO2S.HI/c1-14-9-5-6-12(10-14)11-17(15,16)13-7-3-2-4-8-13;/h2-10H,11H2,1H3;1H/q+1;/p-1
InChIKey GESLCQBQDYBRLK-UHFFFAOYSA-M
Literature Reference Author D.S.GRIERSON,J.L.BETTIOL,I.BUCK,H.P.HUSSON,M.RABIRALTA,A.DIE Z
Literature Reference Citation J.ORG.CHEM.,57,6414(1992)
Literature Reference DOI 10.1021/jo00050a012
Molecular Weight 375.224 g/mol
Solvent CDCl3
Source File Reference UWCS1199