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JVEVGGKGCYQLKS-ZNZDGHLBSA-N
SpectraBase Compound ID 9oO0eCNTmNN
InChI InChI=1S/C21H30O6S/c1-19-8-6-13(22)10-12(19)4-5-14-16(19)11-17(27-28(3,24)25)20(2)15-7-9-21(14,20)26-18(15)23/h12,14-17H,4-11H2,1-3H3/t12-,14?,15-,16?,17-,19+,20+,21+/m1/s1
InChIKey JVEVGGKGCYQLKS-ZNZDGHLBSA-N
Mol Weight 410.53 g/mol
Molecular Formula C21H30O6S
Exact Mass 410.17631 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6e79vvIgzCr
Name JVEVGGKGCYQLKS-ZNZDGHLBSA-N
Compound Number 30
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H30O6S
InChI InChI=1S/C21H30O6S/c1-19-8-6-13(22)10-12(19)4-5-14-16(19)11-17(27-28(3,24)25)20(2)15-7-9-21(14,20)26-18(15)23/h12,14-17H,4-11H2,1-3H3/t12-,14?,15-,16?,17-,19+,20+,21+/m1/s1
InChIKey JVEVGGKGCYQLKS-ZNZDGHLBSA-N
Literature Reference Author G.G.HABERMEHL,P.E.HAMMANN,V.WRAY
Literature Reference Citation MAGN.RES.CHEM.,23,959(1985)
Literature Reference DOI 10.1002/mrc.1260231115
Molecular Weight 410.526 g/mol
Solvent CDCl3
Source File Reference UWWR179