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2-Prenylhydroquinone-1-.beta.-D-glucoside, 5tms derivative
SpectraBase Compound ID 5nTtOaXpC1Z
InChI InChI=1S/C32H64O7Si5/c1-24(2)18-19-25-22-26(36-41(6,7)8)20-21-27(25)34-32-31(39-44(15,16)17)30(38-43(12,13)14)29(37-42(9,10)11)28(35-32)23-33-40(3,4)5/h18,20-22,28-32H,19,23H2,1-17H3/t28-,29-,30+,31-,32-/m1/s1
InChIKey YUUKZZGFHLCAAG-HXBJCGEWSA-N
Mol Weight 701.3 g/mol
Molecular Formula C32H64O7Si5
Exact Mass 700.349837 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1gMq56yupAv
Name 2-Prenylhydroquinone-1-.beta.-D-glucoside, 5tms derivative
Comments Computed using HOSE algorithm
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Exact Mass 700.349837069 u
Formula C32H64O7Si5
InChI InChI=1S/C32H64O7Si5/c1-24(2)18-19-25-22-26(36-41(6,7)8)20-21-27(25)34-32-31(39-44(15,16)17)30(38-43(12,13)14)29(37-42(9,10)11)28(35-32)23-33-40(3,4)5/h18,20-22,28-32H,19,23H2,1-17H3/t28-,29-,30+,31-,32-/m1/s1
InChIKey YUUKZZGFHLCAAG-HXBJCGEWSA-N
SMILES C1(=C(C=C(C=C1)O[Si](C)(C)C)CC=C(C)C)O[C@]1([C@](O[Si](C)(C)C)([C@@](O[Si](C)(C)C)([C@](O[Si](C)(C)C)([C@](O1)(CO[Si](C)(C)C)[H])[H])[H])[H])[H]