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.psi.,.psi.-Carotene, 1,1',2,2'-tetrahydro-1,1'-bis[(trimethylsilyl)oxy]-
SpectraBase Compound ID 9mVeysEe3EA
InChI InChI=1S/C46H76O2Si2/c1-39(27-19-29-41(3)31-21-33-43(5)35-23-37-45(7,8)47-49(11,12)13)25-17-18-26-40(2)28-20-30-42(4)32-22-34-44(6)36-24-38-46(9,10)48-50(14,15)16/h17-22,25-34H,23-24,35-38H2,1-16H3/b18-17+,27-19+,28-20+,31-21+,32-22+,39-25+,40-26+,41-29+,42-30+,43-33+,44-34+
InChIKey OKHWQBMRQWAVDT-MTHKTHNWSA-N
Mol Weight 717.3 g/mol
Molecular Formula C46H76O2Si2
Exact Mass 716.538385 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FJLPMFL0MUW
Name .psi.,.psi.-Carotene, 1,1',2,2'-tetrahydro-1,1'-bis[(trimethylsilyl)oxy]-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 716.538384755 u
Formula C46H76O2Si2
InChI InChI=1S/C46H76O2Si2/c1-39(27-19-29-41(3)31-21-33-43(5)35-23-37-45(7,8)47-49(11,12)13)25-17-18-26-40(2)28-20-30-42(4)32-22-34-44(6)36-24-38-46(9,10)48-50(14,15)16/h17-22,25-34H,23-24,35-38H2,1-16H3/b18-17+,27-19+,28-20+,31-21+,32-22+,39-25+,40-26+,41-29+,42-30+,43-33+,44-34+
InChIKey OKHWQBMRQWAVDT-MTHKTHNWSA-N
Molecular Weight 717.282 g/mol
SMILES C(O[Si](C)(C)C)(CCC\C(=C\C=C\C(=C\C=C\C(=C\C=C\C=C\(\C=C\C=C\(\C=C\C=C\(CCCC(O[Si](C)(C)C)(C)C)C)C)C)C)C)C)(C)C