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(8S,9S,11R)-METHYL-8-IODO-9,11-O-ISOPROPYLIDENE-12,12-DI-(ETHYLTHIO)-DODEC-5-YNOATE
SpectraBase Compound ID L6SAphYP7IT
InChI InChI=1S/C20H33IO4S2/c1-6-26-19(27-7-2)17-14-16(24-20(3,4)25-17)15(21)12-10-8-9-11-13-18(22)23-5/h15-17,19H,6-7,9,11-14H2,1-5H3/t15-,16+,17-/m0/s1
InChIKey FWZSFRBJAIPTTB-BBWFWOEESA-N
Mol Weight 528.5 g/mol
Molecular Formula C20H33IO4S2
Exact Mass 528.086497 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID G017246e5E0
Name (8S,9S,11R)-METHYL-8-IODO-9,11-O-ISOPROPYLIDENE-12,12-DI-(ETHYLTHIO)-DODEC-5-YNOATE
Compound Number 19
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H33IO4S2
InChI InChI=1S/C20H33IO4S2/c1-6-26-19(27-7-2)17-14-16(24-20(3,4)25-17)15(21)12-10-8-9-11-13-18(22)23-5/h15-17,19H,6-7,9,11-14H2,1-5H3/t15-,16+,17-/m0/s1
InChIKey FWZSFRBJAIPTTB-BBWFWOEESA-N
Literature Reference Author T.DURAND,A.GUY,J.P.VIDAL,J.C.ROSSI
Literature Reference Citation J.ORG.CHEM.,67,3615(2002)
Literature Reference DOI 10.1021/jo0109624
Molecular Weight 528.504 g/mol
Solvent CDCl3
Source File Reference UWSI21775