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alpha-(N-ethylanilino)-m-toluenesulfonic acid, hydrate

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alpha-(N-ethylanilino)-m-toluenesulfonic acid, hydrate
SpectraBase Compound ID GXZJf0hgz52
InChI InChI=1S/C15H17NO3S.H2O/c1-2-16(14-8-4-3-5-9-14)12-13-7-6-10-15(11-13)20(17,18)19;/h3-11H,2,12H2,1H3,(H,17,18,19);1H2
InChIKey NYPORDWRBCWHRU-UHFFFAOYSA-N
Mol Weight 309.38 g/mol
Molecular Formula C15H19NO4S
Exact Mass 309.103479 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID G05fE9gTvjs
Name alpha-(N-ETHYLANILINO)-m-TOLUENESULFONIC ACID, HYDRATED
Source of Sample Tokyo Kasei Kogyo Company, Ltd., Tokyo, Japan
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H17NO3S xH2O
InChI InChI=1S/C15H17NO3S.H2O/c1-2-16(14-8-4-3-5-9-14)12-13-7-6-10-15(11-13)20(17,18)19;/h3-11H,2,12H2,1H3,(H,17,18,19);1H2
InChIKey NYPORDWRBCWHRU-UHFFFAOYSA-N
Molecular Weight 291.37
Solvent Deuterium oxide/NaOD; Reference=Dioxane Spectrometer= Varian CFT-20
Synonyms M-TOLUENESULFONIC ACID, A-/N-ETHYLANILINO/-, HYDRATED