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2,3-OCTAHYDROBENZO-2,5-DIHYDROTHIOPHENE-1,1-DIOXIDE

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2,3-OCTAHYDROBENZO-2,5-DIHYDROTHIOPHENE-1,1-DIOXIDE
SpectraBase Compound ID EIcGkt5R7sf
InChI InChI=1S/C8H12O2S/c9-11(10)6-5-7-3-1-2-4-8(7)11/h5,8H,1-4,6H2
InChIKey ZBLPCLBCOGTYAK-UHFFFAOYSA-N
Mol Weight 172.24 g/mol
Molecular Formula C8H12O2S
Exact Mass 172.055801 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HAzLy8p9HUH
Name 2,4,5,6,7,7-Hexahydro-benzothiophene 1,1-dioxide
CAS Registry Number 42854-47-7
Comments BRUKER CXP-100
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C8H12O2S
InChI InChI=1S/C8H12O2S/c9-11(10)6-5-7-3-1-2-4-8(7)11/h5,8H,1-4,6H2
InChIKey ZBLPCLBCOGTYAK-UHFFFAOYSA-N
Instrument Name see comment
Literature Reference J. Mc Intosh, Can. J. Chem. 57, 131 (1979).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3