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4,6-DIMETHYL-2-BETA-PHENYL-1,3-DITHIANE-1-OXIDE
SpectraBase Compound ID DSAjGQ97BsJ
InChI InChI=1S/C12H16OS2/c1-9-8-10(2)15(13)12(14-9)11-6-4-3-5-7-11/h3-7,9-10,12H,8H2,1-2H3/t9-,10+,12+,15?/m1/s1
InChIKey DQFIBIHHKBFCQU-NWBLYEJDSA-N
Mol Weight 240.38 g/mol
Molecular Formula C12H16OS2
Exact Mass 240.064257 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1cVbwTXKXKr
Name 4,6-DIMETHYL-2-BETA-PHENYL-1,3-DITHIANE-1-OXIDE
Compound Number 2-PH
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H16OS2
InChI InChI=1S/C12H16OS2/c1-9-8-10(2)15(13)12(14-9)11-6-4-3-5-7-11/h3-7,9-10,12H,8H2,1-2H3/t9-,10+,12+,15?/m1/s1
InChIKey DQFIBIHHKBFCQU-NWBLYEJDSA-N
Literature Reference Author A.TOUTCHKINE,E.L.CLENNAN
Literature Reference Citation J.ORG.CHEM.,64,5620(1999)
Literature Reference DOI 10.1021/jo990709s
Molecular Weight 240.378 g/mol
Sample ID 40155
Solvent CDCl3