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[3,4,5-Trihydroxy-6-(hydroxymethyl)oxan-2-yl] 3-hydroxy-4,5-dimethoxybenzoate, 5tms derivative

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[3,4,5-Trihydroxy-6-(hydroxymethyl)oxan-2-yl] 3-hydroxy-4,5-dimethoxybenzoate, 5tms derivative
SpectraBase Compound ID JvQfYJ0MVpd
InChI InChI=1S/C30H60O10Si5/c1-32-22-18-21(19-23(25(22)33-2)37-42(6,7)8)29(31)36-30-28(40-45(15,16)17)27(39-44(12,13)14)26(38-43(9,10)11)24(35-30)20-34-41(3,4)5/h18-19,24,26-28,30H,20H2,1-17H3
InChIKey YQMWNBOKNXYEDX-UHFFFAOYSA-N
Mol Weight 721.2 g/mol
Molecular Formula C30H60O10Si5
Exact Mass 720.303281 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LaXNf2M9mHB
Name [3,4,5-Trihydroxy-6-(hydroxymethyl)oxan-2-yl] 3-hydroxy-4,5-dimethoxybenzoate, 5tms derivative
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 720.303280797 u
Formula C30H60O10Si5
InChI InChI=1S/C30H60O10Si5/c1-32-22-18-21(19-23(25(22)33-2)37-42(6,7)8)29(31)36-30-28(40-45(15,16)17)27(39-44(12,13)14)26(38-43(9,10)11)24(35-30)20-34-41(3,4)5/h18-19,24,26-28,30H,20H2,1-17H3
InChIKey YQMWNBOKNXYEDX-UHFFFAOYSA-N
Molecular Weight 721.225 g/mol
SMILES C(C1=CC(=C(C(=C1)OC)OC)O[Si](C)(C)C)(=O)OC1C(O[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C(CO[Si](C)(C)C)O1