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5-METHOXY-1,6-DITHIACYCLODECA-4-ENE-2-YNE

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5-METHOXY-1,6-DITHIACYCLODECA-4-ENE-2-YNE
SpectraBase Compound ID 4xmnSpKQaRt
InChI InChI=1S/C9H12OS2/c1-10-9-5-4-7-11-6-2-3-8-12-9/h5H,2-3,6,8H2,1H3/b9-5-
InChIKey ISNYCQOUNBUTIT-UITAMQMPSA-N
Mol Weight 200.31 g/mol
Molecular Formula C9H12OS2
Exact Mass 200.032957 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Dkp3cUWGQGG
Name 5-METHOXY-1,6-DITHIACYCLODECA-4-ENE-2-YNE
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C9H12OS2
InChI InChI=1S/C9H12OS2/c1-10-9-5-4-7-11-6-2-3-8-12-9/h5H,2-3,6,8H2,1H3/b9-5-
InChIKey ISNYCQOUNBUTIT-UITAMQMPSA-N
Literature Reference Author D.B.WERZ,R.GLEITER,F.ROMINGER
Literature Reference Citation J.ORG.CHEM.,69,2945(2004)
Literature Reference DOI 10.1021/jo035882+
Molecular Weight 200.314 g/mol
Solvent CDCl3
Source File Reference UWVN21316