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(3S,4S,3'S,4'S)-3,4,3',4'-TETRAKIS-[(TRIMETHYLSILYL)-OXY]-BETA,BETA-CAROTINE
SpectraBase Compound ID L5cfwX35gif
InChI InChI=1S/C52H86O4Si4/c1-39(29-25-31-41(3)33-35-45-43(5)49(55-59(17,18)19)47(37-51(45,7)8)53-57(11,12)13)27-23-24-28-40(2)30-26-32-42(4)34-36-46-44(6)50(56-60(20,21)22)48(38-52(46,9)10)54-58(14,15)16/h25-36,47-50H,37-38H2,1-22H3/b29-25+,30-26+,35-33+,36-34+,39-27-,40-28-,41-31-,42-32+/t47-,48+,49-,50+/m0/s1
InChIKey YHPCJPLVOPPRKH-XCRFTGMFSA-N
Mol Weight 887.6 g/mol
Molecular Formula C52H86O4Si4
Exact Mass 886.560317 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3NJQzTNZFf9
Name (3S,4S,3'S,4'S)-3,4,3',4'-TETRAKIS-[(TRIMETHYLSILYL)-OXY]-BETA,BETA-CAROTINE
Compound Number 48
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C52H86O4Si4
InChI InChI=1S/C52H86O4Si4/c1-39(29-25-31-41(3)33-35-45-43(5)49(55-59(17,18)19)47(37-51(45,7)8)53-57(11,12)13)27-23-24-28-40(2)30-26-32-42(4)34-36-46-44(6)50(56-60(20,21)22)48(38-52(46,9)10)54-58(14,15)16/h25-36,47-50H,37-38H2,1-22H3/b29-25+,30-26+,35-33+,36-34+,39-27-,40-28-,41-31-,42-32+/t47-,48+,49-,50+/m0/s1
InChIKey YHPCJPLVOPPRKH-XCRFTGMFSA-N
Literature Reference Author D.J.BUSCHOR,C.H.EUGSTER
Literature Reference Citation HELV.CHIM.ACTA,73,1002(1990)
Literature Reference DOI 10.1002/hlca.19900730426
Molecular Weight 887.594 g/mol
Solvent CDCl3
Source File Reference UWCS12569