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2,3-dimethyl-6-nitrobanzothiazolium p-toluenesulfonate

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

2,3-dimethyl-6-nitrobanzothiazolium p-toluenesulfonate
SpectraBase Compound ID 4UiaffZdcwG
InChI InChI=1S/C9H9N2O2S.C7H8O3S/c1-6-10(2)8-4-3-7(11(12)13)5-9(8)14-6;1-6-2-4-7(5-3-6)11(8,9)10/h3-5H,1-2H3;2-5H,1H3,(H,8,9,10)/q+1;/p-1
InChIKey QHVZYSIEYHLOJN-UHFFFAOYSA-M
Mol Weight 380.43 g/mol
Molecular Formula C16H16N2O5S2
Exact Mass 380.050064 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID 5kn6fdOEcE1
Name 2,3-DIMETHYL-6-NITROBENZOTHIAZOLIUM p-TOLUENESULFONATE
Source of Sample Aldrich Chemical Company, Inc., Milwaukee, Wisconsin
Catalog Number S39692
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H16N2O5S2
InChI InChI=1S/C9H9N2O2S.C7H8O3S/c1-6-10(2)8-4-3-7(11(12)13)5-9(8)14-6;1-6-2-4-7(5-3-6)11(8,9)10/h3-5H,1-2H3;2-5H,1H3,(H,8,9,10)/q+1;/p-1
InChIKey QHVZYSIEYHLOJN-UHFFFAOYSA-M
Molecular Weight 380.433014
Synonyms BENZOTHIAZOLIUM P-TOLUENESULFONATE, 2,3-DIMETHYL-6-NITRO-,
Technique KBr WAFER