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m-(5-HYDROXY-3-METHYLPYRAZOL-1-YL)BENZENESULFONIC ACID
SpectraBase Compound ID 7nSivFhXuHV
InChI InChI=1S/C10H10N2O4S/c1-7-5-10(13)12(11-7)8-3-2-4-9(6-8)17(14,15)16/h2-6,13H,1H3,(H,14,15,16)
InChIKey JTGUAOMMAPTQIS-UHFFFAOYSA-N
Mol Weight 254.26 g/mol
Molecular Formula C10H10N2O4S
Exact Mass 254.036128 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 48CdHHIiJCa
Name m-(5-HYDROXY-3-METHYLPYRAZOL-1-YL)BENZENESULFONIC ACID
Source of Sample A. Hardt, W. Bremser BASF Ludwigshafen (1984)
CAS Registry Number 119-17-5
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H10N2O4S
InChI InChI=1S/C10H10N2O4S/c1-7-5-10(13)12(11-7)8-3-2-4-9(6-8)17(14,15)16/h2-6,13H,1H3,(H,14,15,16)
InChIKey JTGUAOMMAPTQIS-UHFFFAOYSA-N
Molecular Weight 254.27
Solvent Dimethyl sulfoxide-d6; Reference=TMS; Temperature=Ambient Spectrometer= Bruker WM-360
Synonyms BENZENESULFONIC ACID, M-/5-HYDROXY- 3-METHYLPYRAZOL-1-YL/-,