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3-cyano-1-(2-methoxyethyl)pyridinium p-toluenesulfonate

View entire compound with spectra: 2 NMR, and 1 FTIR

3-cyano-1-(2-methoxyethyl)pyridinium p-toluenesulfonate
SpectraBase Compound ID 7ItpHzWkpL7
InChI InChI=1S/C9H11N2O.C7H8O3S/c1-12-6-5-11-4-2-3-9(7-10)8-11;1-6-2-4-7(5-3-6)11(8,9)10/h2-4,8H,5-6H2,1H3;2-5H,1H3,(H,8,9,10)/q+1;/p-1
InChIKey LLOXNBUYQLKISG-UHFFFAOYSA-M
Mol Weight 334.39 g/mol
Molecular Formula C16H18N2O4S
Exact Mass 334.098728 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Jl2oNo7XXd6
Name 3-CYANO-1-(2-METHOXYETHYL)PYRIDINIUM p-TOLUENESULFONATE
Source of Sample Aldrich Chemical Company, Inc., Milwaukee, Wisconsin
Copyright Copyright © 1991-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H18N2O4S
InChI InChI=1S/C9H11N2O.C7H8O3S/c1-12-6-5-11-4-2-3-9(7-10)8-11;1-6-2-4-7(5-3-6)11(8,9)10/h2-4,8H,5-6H2,1H3;2-5H,1H3,(H,8,9,10)/q+1;/p-1
InChIKey LLOXNBUYQLKISG-UHFFFAOYSA-M
Instrument Name BRUKER AC-300
Molecular Weight 334.40
Solvent Polysol; Reference=TMS; Temperature 297K