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1-[2-(1,3-DITHIANYL)]-3-(FORMYLOXY)-2-METHYL-1-CYCLOHEXENE
SpectraBase Compound ID 6URdoof0I58
InChI InChI=1S/C12H18O2S2/c1-9-10(12-15-6-3-7-16-12)4-2-5-11(9)14-8-13/h8,11-12H,2-7H2,1H3
InChIKey IZTSWLWEAZXBTL-UHFFFAOYSA-N
Mol Weight 258.39 g/mol
Molecular Formula C12H18O2S2
Exact Mass 258.074822 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8APr4fbgEoW
Name 1-[2-(1,3-DITHIANYL)]-3-(FORMYLOXY)-2-METHYL-1-CYCLOHEXENE
Compound Number 25
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H18O2S2
InChI InChI=1S/C12H18O2S2/c1-9-10(12-15-6-3-7-16-12)4-2-5-11(9)14-8-13/h8,11-12H,2-7H2,1H3
InChIKey IZTSWLWEAZXBTL-UHFFFAOYSA-N
Literature Reference Author D.H.HUA,Y.CHEN,H.S.SIN,M.J.MARORO,P.D.ROBINSON,S.W.NEWELL,E. M.PERCHELLET,J.B.LAD
Literature Reference Citation J.ORG.CHEM.,62,6888(1997)
Literature Reference DOI 10.1021/jo970642d
Molecular Weight 258.394 g/mol
Solvent CDCl3
Source File Reference UWMZ4415