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(1S,2S,3S,6S,7S,8R,12S)-3,7-DIBENZYLOXY-6-(3-BUTENYL)-6-(CYCLOHEXYLDIMETHYLSILOXY)-2,12-(ISOPROPYLIDENEDIOXY)-1,5,5-TRIMETHYL-9-METHYLENEBICYCLO-
SpectraBase Compound ID ABalD0fsGQn
InChI InChI=1S/C45H64O6Si/c1-10-11-29-45(51-52(8,9)35-25-19-14-20-26-35)40(48-31-34-23-17-13-18-24-34)37-32(2)27-28-36-44(37,7)41(50-43(5,6)49-36)38(39(46)42(45,3)4)47-30-33-21-15-12-16-22-33/h10,12-13,15-18,21-24,35-38,40-41H,1-2,11,14,19-20,25-31H2,3-9H3/t36-,37?,38+,40?,41+,44+,45+/m0/s1
InChIKey FSDNWDGYUWTGCC-UGYJEPCUSA-N
Mol Weight 729.1 g/mol
Molecular Formula C45H64O6Si
Exact Mass 728.447216 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FwqGtgU8qha
Name (1S,2S,3S,6S,7S,8R,12S)-3,7-DIBENZYLOXY-6-(3-BUTENYL)-6-(CYCLOHEXYLDIMETHYLSILOXY)-2,12-(ISOPROPYLIDENEDIOXY)-1,5,5-TRIMETHYL-9-METHYLENEBICYCLO-
Compound Number 50A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C45H64O6Si
InChI InChI=1S/C45H64O6Si/c1-10-11-29-45(51-52(8,9)35-25-19-14-20-26-35)40(48-31-34-23-17-13-18-24-34)37-32(2)27-28-36-44(37,7)41(50-43(5,6)49-36)38(39(46)42(45,3)4)47-30-33-21-15-12-16-22-33/h10,12-13,15-18,21-24,35-38,40-41H,1-2,11,14,19-20,25-31H2,3-9H3/t36-,37?,38+,40?,41+,44+,45+/m0/s1
InChIKey FSDNWDGYUWTGCC-UGYJEPCUSA-N
Literature Reference Author T.MUKAIYAMA,I.SHIINA,H.IWADARE,M.SAITOH,T.NISHIMURA,N.OHKAWA ,H.SAKOH,K.NISHIMURA
Literature Reference Citation CHEM.EUR.J.,5,121(1999)
Literature Reference DOI 10.1002/(sici)1521-3765(19990104)5:1<121::aid-chem121>3.3.co;2-f
Molecular Weight 729.085 g/mol
Solvent C6D6
Source File Reference UWRU9504