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trans-HEXAHYDRO-1,4-BENZODITHIAN, 1beta-OXIDE

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trans-HEXAHYDRO-1,4-BENZODITHIAN, 1beta-OXIDE
SpectraBase Compound ID EScywo8pAOi
InChI InChI=1S/C8H14OS2/c9-11-6-5-10-7-3-1-2-4-8(7)11/h7-8H,1-6H2
InChIKey KLAVRTJNICOISJ-UHFFFAOYSA-N
Mol Weight 190.32 g/mol
Molecular Formula C8H14OS2
Exact Mass 190.048607 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Cxb3YMPxCKe
Name 1,4-Dithia-trans-decaline 1a-oxide
CAS Registry Number 71989-45-2
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C8H14OS2
InChI InChI=1S/C8H14OS2/c9-11-6-5-10-7-3-1-2-4-8(7)11/h7-8H,1-6H2
InChIKey KLAVRTJNICOISJ-UHFFFAOYSA-N
Instrument Name Varian XL-100
Literature Reference R.P. Rooney, S.A. Evans, J. Org. Chem. 45, 180 (1980).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3