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(8R,9S,11R)-METHYL-8-IODO-12,12-DI-(ETHYLTHIO)-9,11-DIHYDROXYDODEC-5-YNOATE
SpectraBase Compound ID Gexx19ORb0
InChI InChI=1S/C17H29IO4S2/c1-4-23-17(24-5-2)15(20)12-14(19)13(18)10-8-6-7-9-11-16(21)22-3/h13-15,17,19-20H,4-5,7,9-12H2,1-3H3/t13-,14-,15+/m0/s1
InChIKey MNVKCJZAALVEJC-SOUVJXGZSA-N
Mol Weight 488.44 g/mol
Molecular Formula C17H29IO4S2
Exact Mass 488.055197 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7c7s6otRhp9
Name (8R,9S,11R)-METHYL-8-IODO-12,12-DI-(ETHYLTHIO)-9,11-DIHYDROXYDODEC-5-YNOATE
Compound Number 5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H29IO4S2
InChI InChI=1S/C17H29IO4S2/c1-4-23-17(24-5-2)15(20)12-14(19)13(18)10-8-6-7-9-11-16(21)22-3/h13-15,17,19-20H,4-5,7,9-12H2,1-3H3/t13-,14-,15+/m0/s1
InChIKey MNVKCJZAALVEJC-SOUVJXGZSA-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 488.439 g/mol
Solvent CDCl3
Source File Reference UWSI21764