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1-(4-Tolyl-sulfonyl)-1H-1,2,4-triazole

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1-(4-Tolyl-sulfonyl)-1H-1,2,4-triazole
SpectraBase Compound ID E7KGH9LHJnx
InChI InChI=1S/C9H9N3O2S/c1-8-2-4-9(5-3-8)15(13,14)12-7-10-6-11-12/h2-7H,1H3
InChIKey GFWABQNSSIQCLB-UHFFFAOYSA-N
Mol Weight 223.25 g/mol
Molecular Formula C9H9N3O2S
Exact Mass 223.041548 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KsJeSLA4wD3
Name 1-(4-Tolyl-sulfonyl)-1H-1,2,4-triazole
CAS Registry Number 13578-51-3
Copyright Copyright © 2002-2025 Wiley-VCH GmbH. All Rights Reserved.
Formula C9H9N3O2S
InChI InChI=1S/C9H9N3O2S/c1-8-2-4-9(5-3-8)15(13,14)12-7-10-6-11-12/h2-7H,1H3
InChIKey GFWABQNSSIQCLB-UHFFFAOYSA-N
Instrument Name Varian CFT-20
Literature Reference M. Begtrup, J. Elguero, R. Faure, Magn. Res. Chem. 26, 134 (1988).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent DMSO-D6