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1-(3-Sulfopropyl)pyridinium hydroxide inner salt
SpectraBase Compound ID 9MnuAu88Hy8
InChI InChI=1S/C8H11NO3S/c10-13(11,12)8-4-7-9-5-2-1-3-6-9/h1-3,5-6H,4,7-8H2
InChIKey REEBJQTUIJTGAL-UHFFFAOYSA-N
Mol Weight 201.24 g/mol
Molecular Formula C8H11NO3S
Exact Mass 201.045964 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AGoQiQwF1DJ
Name Pyridine-1-propane-3'-sulfonate
CAS Registry Number 15471-17-7
Comments reassigned
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C8H11NO3S
InChI InChI=1S/C8H11NO3S/c10-13(11,12)8-4-7-9-5-2-1-3-6-9/h1-3,5-6H,4,7-8H2
InChIKey REEBJQTUIJTGAL-UHFFFAOYSA-N
Instrument Name Jeol FX-100
Literature Reference J.R. Andersen, O. Jorgensen, B.S. Jensen, Acta Chem. Scand. B33, 695 (1979).
NMR Standard not reported
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent D2O