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2-{3-[4-METHOXYPHENYL]PROP-2-ENYL}-2-TRIFLUOROMETHYLCYCLOPENTANE-1,3-DIOL BIS(TERT-BUTYLDIMETHYLSILYL ETHER) (ISOMER MIXTURE)

View entire compound with spectra: 1 NMR

2-{3-[4-METHOXYPHENYL]PROP-2-ENYL}-2-TRIFLUOROMETHYLCYCLOPENTANE-1,3-DIOL BIS(TERT-BUTYLDIMETHYLSILYL ETHER) (ISOMER MIXTURE)
SpectraBase Compound ID 1eaKBKYnvby
InChI InChI=1S/C28H47F3O3Si2/c1-25(2,3)35(8,9)33-23-18-19-24(34-36(10,11)26(4,5)6)27(23,28(29,30)31)20-12-13-21-14-16-22(32-7)17-15-21/h12-17,23-24H,18-20H2,1-11H3/b13-12+
InChIKey BGLPLRQWZAFPEO-OUKQBFOZSA-N
Mol Weight 544.8 g/mol
Molecular Formula C28H47F3O3Si2
Exact Mass 544.301583 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KjsfW96xyt1
Name 2-{3-[4-METHOXYPHENYL]PROP-2-ENYL}-2-TRIFLUOROMETHYLCYCLOPENTANE-1,3-DIOL BIS(TERT-BUTYLDIMETHYLSILYL ETHER) (ISOMER MIXTURE)
Comments I(-62.2):I(-66.5):I(-72.3)=28:66:6.
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C28H47F3O3Si2
InChI InChI=1S/C28H47F3O3Si2/c1-25(2,3)35(8,9)33-23-18-19-24(34-36(10,11)26(4,5)6)27(23,28(29,30)31)20-12-13-21-14-16-22(32-7)17-15-21/h12-17,23-24H,18-20H2,1-11H3/b13-12+
InChIKey BGLPLRQWZAFPEO-OUKQBFOZSA-N
Instrument Name Bruker AC-200
Literature Reference J.C.BLAZEJEWSKI, M.HADDAN, C.WAKSELMAN (1991) J.Fluor.Chem.: v.52, N3, 353-360.
NMR Standard CCl3F
Observed nucleus 19F
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3 chloroform-d