John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=FGATH7ASCem SpectraBase Spectrum ID=2BwncXDXup5

(accessed ).
(4S)-E-3-[3-([1,3]-DITHIAN-2-YL)-3-METHYLBUTYLIDENE]-4-HYDROXY-4,5-DIHYDROFURAN-2-ONE
SpectraBase Compound ID FGATH7ASCem
InChI InChI=1S/C13H20O3S2/c1-13(2,12-17-6-3-7-18-12)5-4-9-10(14)8-16-11(9)15/h4,10,12,14H,3,5-8H2,1-2H3/b9-4+/t10-/m1/s1
InChIKey JVWFHQVSTDFBBC-WXLQGSQKSA-N
Mol Weight 288.42 g/mol
Molecular Formula C13H20O3S2
Exact Mass 288.085388 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2BwncXDXup5
Name (4S)-E-3-[3-([1,3]-DITHIAN-2-YL)-3-METHYLBUTYLIDENE]-4-HYDROXY-4,5-DIHYDROFURAN-2-ONE
Compound Number 16
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H20O3S2
InChI InChI=1S/C13H20O3S2/c1-13(2,12-17-6-3-7-18-12)5-4-9-10(14)8-16-11(9)15/h4,10,12,14H,3,5-8H2,1-2H3/b9-4+/t10-/m1/s1
InChIKey JVWFHQVSTDFBBC-WXLQGSQKSA-N
Literature Reference Author D.J.EDMONDS,K.W.MUIR,D.J.PROCTER
Literature Reference Citation J.ORG.CHEM.,68,3190(2003)
Literature Reference DOI 10.1021/jo026827o
Molecular Weight 288.420 g/mol
Solvent CDCl3
Source File Reference UWMS26331
SpectraBase Batch ID IR4Z60aplD0