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Benzo[b]thiophene, 1,1-dioxide
SpectraBase Compound ID GBdGxW2SG0n
InChI InChI=1S/C8H6O2S/c9-11(10)6-5-7-3-1-2-4-8(7)11/h1-6H
InChIKey FRJNKYGTHPUSJR-UHFFFAOYSA-N
Mol Weight 166.19 g/mol
Molecular Formula C8H6O2S
Exact Mass 166.008851 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JgUqdZAZtQ8
Name Thianaphthen 1,1-dioxide
CAS Registry Number 825-44-5
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C8H6O2S
InChI InChI=1S/C8H6O2S/c9-11(10)6-5-7-3-1-2-4-8(7)11/h1-6H
InChIKey FRJNKYGTHPUSJR-UHFFFAOYSA-N
Instrument Name Bruker HX-90
Literature Reference P. Geneste, J.L. Olive, J. Org. Chem. 44, 2887 (1979).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3