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8-Anti-[4-(m-Trifluoromethylphenoxy)-3(R)-tert-butyldimethylsilyloxy-1(E)-butenyl]-6-(S)-endo-tert-butyldimethylsilyloxy-2-oxabicyclo[3.2.1]octan-3-one
SpectraBase Compound ID 16UwZgCGMkA
InChI InChI=1S/C30H47F3O5Si2/c1-28(2,3)39(7,8)37-22(19-35-21-13-11-12-20(16-21)30(31,32)33)14-15-23-24-17-27(34)36-25(23)18-26(24)38-40(9,10)29(4,5)6/h11-16,22-26H,17-19H2,1-10H3/b15-14+/t22-,23+,24-,25-,26+/m1/s1
InChIKey AEQQIUAEOTUXHF-MMONRCCMSA-N
Mol Weight 600.9 g/mol
Molecular Formula C30H47F3O5Si2
Exact Mass 600.291412 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID rOAG62zFjh
Name 8-Anti-[4-(m-Trifluoromethylphenoxy)-3(R)-tert-butyldimethylsilyloxy-1(E)-butenyl]-6-(S)-endo-tert-butyldimethylsilyloxy-2-oxabicyclo[3.2.1]octan-3-one
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Formula C30H47F3O5Si2
InChI InChI=1S/C30H47F3O5Si2/c1-28(2,3)39(7,8)37-22(19-35-21-13-11-12-20(16-21)30(31,32)33)14-15-23-24-17-27(34)36-25(23)18-26(24)38-40(9,10)29(4,5)6/h11-16,22-26H,17-19H2,1-10H3/b15-14+/t22-,23+,24-,25-,26+/m1/s1
InChIKey AEQQIUAEOTUXHF-MMONRCCMSA-N
Molecular Weight 600.866 g/mol
SMILES [C@]12([C@]([C@]([C@](C2)(O[Si](C(C)(C)C)(C)C)[H])(CC(O1)=O)[H])(\C=C\[C@@](O[Si](C(C)(C)C)(C)C)(COc1cc(C(F)(F)F)ccc1)[H])[H])[H]
SPLASH splash10-00di-9030000000-7a68f6cf5881531d3c77
Source of Spectrum OV-6-144-16
Synonyms (6S)-6-{[tert-butyl(dimethyl)silyl]oxy}-8-{(1E,3R)-3-{[tert-butyl(dimethyl)silyl]oxy}-4-[3-(trifluoromethyl)phenoxy]-1-butenyl}-2-oxabicyclo[3.2.1]octan-3-one 8-Anti-[4-(m-Trifluporomethylphenoxy)-3(R)-tert-butyldimethylsilyloxy-1(E)-butenyl]-6-(S)-endo-tert-butyldimethylsilyloxy-2-oxabicyclo[3.2.1]octan-3-one
Wiley ID 1547650