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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 LC7lJ04fiGm
Name trans-HEXAHYDRO-1,4-BENZODITHIAN, 1alpha-OXIDE
Source of Sample R. P. Rooney, S. A. Evans J. Org. Chem. 45, 180(1980)
CAS Registry Number 71989-45-2
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. 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
Molecular Weight 190.33
Solvent Chloroform-d; Reference=TMS; Temperature=303 K Spectrometer= Varian XL-100
Synonyms 1,4-BENZODITHIAN, HEXAHYDRO-, 1A-OXIDE, trans-,