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p-Toluenesulfonic acid monohydrate

View entire compound with spectra: 4 NMR, 5 FTIR, and 1 Raman

p-Toluenesulfonic acid monohydrate
SpectraBase Compound ID BETIeYFrjUA
InChI InChI=1S/C7H8O3S.H2O/c1-6-2-4-7(5-3-6)11(8,9)10;/h2-5H,1H3,(H,8,9,10);1H2
InChIKey KJIFKLIQANRMOU-UHFFFAOYSA-N
Mol Weight 190.21 g/mol
Molecular Formula C7H10O4S
Exact Mass 190.02998 g/mol

Attenuated Total Reflectance Infrared (ATR-IR) Spectrum

Attenuated Total Reflectance Infrared (ATR-IR) Spectrum

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SpectraBase Spectrum ID Gsi1eiz5YO6
Name p-Toluenesulfonic acid, monohydrate
Boiling Point 428.9 °C
CAS Registry Number 6192-52-5
Comments Atmospheric correction
Compound Type Pure
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Detector Name LiTa03
Formula C7H10O4S
InChI InChI=1S/C7H8O3S.H2O/c1-6-2-4-7(5-3-6)11(8,9)10;/h2-5H,1H3,(H,8,9,10);1H2
InChIKey KJIFKLIQANRMOU-UHFFFAOYSA-N
Instrument Name PerkinElmer SpectrumTwo
Melting Point 96.0 - 99.0 °C
Sample Description crystalline powder
Technique ATR-IR