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(1R,4S,5S,6R,4'S)-4-Methoxymethoxy-1-methyl-6-(2',2'-dimethyl-1',3'-dioxolan-4'-yl)-5-p-toluenesulfonyloxymethylbicxyclo[2.2.2]octane-2-one

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(1R,4S,5S,6R,4'S)-4-Methoxymethoxy-1-methyl-6-(2',2'-dimethyl-1',3'-dioxolan-4'-yl)-5-p-toluenesulfonyloxymethylbicxyclo[2.2.2]octane-2-one
SpectraBase Compound ID 6MSEeQm8C9o
InChI InChI=1S/C24H34O8S/c1-16-6-8-17(9-7-16)33(26,27)31-13-18-21(19-14-29-22(2,3)32-19)23(4)10-11-24(18,12-20(23)25)30-15-28-5/h6-9,18-19,21H,10-15H2,1-5H3/t18-,19-,21-,23+,24+/m1/s1
InChIKey FQGBOXVJPMUALD-CLODTNMZSA-N
Mol Weight 482.6 g/mol
Molecular Formula C24H34O8S
Exact Mass 482.197439 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ALvWQujX7ak
Name (1R,4S,5S,6R,4'S)-4-Methoxymethoxy-1-methyl-6-(2',2'-dimethyl-1',3'-dioxolan-4'-yl)-5-p-toluenesulfonyloxymethylbicxyclo[2.2.2]octane-2-one
Alternate Name(s) (1R,4S,5S,6R,4'S)-4-Methoxymethoxy-1-methyl-6-((S)-2',2'-dimethyl-1',3'-dioxolan-4'-yl)-5-p-toluenesulfonyloxymethylbicxyclo[2.2.2]octane-2-one [(1R,2S,3S,4R)-3-[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]-1-(methoxymethoxy)-4-methyl-5-oxobicyclo[2.2.2]oct-2-yl]methyl 4-methylbenzenesulfonate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H34O8S
InChI InChI=1S/C24H34O8S/c1-16-6-8-17(9-7-16)33(26,27)31-13-18-21(19-14-29-22(2,3)32-19)23(4)10-11-24(18,12-20(23)25)30-15-28-5/h6-9,18-19,21H,10-15H2,1-5H3/t18-,19-,21-,23+,24+/m1/s1
InChIKey FQGBOXVJPMUALD-CLODTNMZSA-N
Molecular Weight 482.588 g/mol
SMILES C(OS(c1ccc(cc1)C)(=O)=O)[C@]1([C@]2(CC([C@@]([C@]1([C@@]1(OC(C)(C)OC1)[H])[H])(CC2)C)=O)OCOC)[H]
SPLASH splash10-00kf-0900700000-aa350a6b385f39972c11
Source of Spectrum F-50-676-19
Wiley ID 1395565