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2-(4-Methoxyphenyl)ethyl-.beta.-D-glucopyranoside, 4tms

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2-(4-Methoxyphenyl)ethyl-.beta.-D-glucopyranoside, 4tms
SpectraBase Compound ID 7n32a8wumKO
InChI InChI=1S/C27H54O7Si4/c1-28-22-16-14-21(15-17-22)18-19-29-27-26(34-38(11,12)13)25(33-37(8,9)10)24(32-36(5,6)7)23(31-27)20-30-35(2,3)4/h14-17,23-27H,18-20H2,1-13H3/t23-,24-,25+,26-,27-/m1/s1
InChIKey HDNDHQUSZYOVBI-IURCNINISA-N
Mol Weight 603.1 g/mol
Molecular Formula C27H54O7Si4
Exact Mass 602.29466 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8x0Bd1VIyQb
Name 2-(4-Methoxyphenyl)ethyl-.beta.-D-glucopyranoside, 4tms
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 602.294660212 u
Formula C27H54O7Si4
InChI InChI=1S/C27H54O7Si4/c1-28-22-16-14-21(15-17-22)18-19-29-27-26(34-38(11,12)13)25(33-37(8,9)10)24(32-36(5,6)7)23(31-27)20-30-35(2,3)4/h14-17,23-27H,18-20H2,1-13H3/t23-,24-,25+,26-,27-/m1/s1
InChIKey HDNDHQUSZYOVBI-IURCNINISA-N
Molecular Weight 603.062 g/mol
SMILES C1=C(C=CC(=C1)CCO[C@@]1(O[C@@]([C@]([C@@]([C@]1(O[Si](C)(C)C)[H])(O[Si](C)(C)C)[H])(O[Si](C)(C)C)[H])(CO[Si](C)(C)C)[H])[H])OC