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(4R,5S,9S,10S,11S)-Morel-2-en-1,7-dione 7-ethylenedithioketal
SpectraBase Compound ID 2SiPH6E74sL
InChI InChI=1S/C17H24OS2/c1-9-7-12(18)14-10(2)11-8-17(19-5-6-20-17)16(3,4)15(14)13(9)11/h7,10-11,13-15H,5-6,8H2,1-4H3/t10-,11-,13-,14-,15?/m0/s1
InChIKey ILXWFKWBRLRATJ-BXUSZUDFSA-N
Mol Weight 308.5 g/mol
Molecular Formula C17H24OS2
Exact Mass 308.126858 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID dHlQG16aqG
Name (4R,5S,9S,10S,11S)-MOREL-2-EN-1,7-DIONE-7-ETHYLENEDITHIOKETAL
Compound Number 6
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H24OS2
InChI InChI=1S/C17H24OS2/c1-9-7-12(18)14-10(2)11-8-17(19-5-6-20-17)16(3,4)15(14)13(9)11/h7,10-11,13-15H,5-6,8H2,1-4H3/t10-,11-,13-,14-,15?/m0/s1
InChIKey ILXWFKWBRLRATJ-BXUSZUDFSA-N
Literature Reference Author C.M.CERDA-GARCIA-ROJAS,M.A.BUCIO,L.U.ROMAN,J.D.HERNANDEZ,P.J OSEPH-NATHAN
Literature Reference Citation J.NAT.PROD.,67,189(2004)
Literature Reference DOI 10.1021/np030354e
Molecular Weight 308.497 g/mol
Solvent CDCl3
Source File Reference UWKP3527