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2,7-DITHIA-[8.1]-METACYCLOPHAN-15-ONE

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2,7-DITHIA-[8.1]-METACYCLOPHAN-15-ONE
SpectraBase Compound ID Hi3nFc1BAZk
InChI InChI=1S/C19H20OS2/c20-19-17-7-3-5-15(11-17)13-21-9-1-2-10-22-14-16-6-4-8-18(19)12-16/h3-8,11-12H,1-2,9-10,13-14H2
InChIKey VKIODDPJUUWRDQ-UHFFFAOYSA-N
Mol Weight 328.49 g/mol
Molecular Formula C19H20OS2
Exact Mass 328.095558 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID B8Gi2Iifvuc
Name 2,7-DITHIA-[8.1]-METACYCLOPHAN-15-ONE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C19H20OS2
InChI InChI=1S/C19H20OS2/c20-19-17-7-3-5-15(11-17)13-21-9-1-2-10-22-14-16-6-4-8-18(19)12-16/h3-8,11-12H,1-2,9-10,13-14H2
InChIKey VKIODDPJUUWRDQ-UHFFFAOYSA-N
Literature Reference Author D.A.SHULTZ,M.A.FOX
Literature Reference Citation J.AM.CHEM.SOC.,111,6311(1989)
Literature Reference DOI 10.1021/ja00198a049
Molecular Weight 328.487 g/mol
Solvent CDCl3
Source File Reference UWCS2534