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(2R,3S,4S,5R,6R)-2-(Hydroxymethyl)-6-(4-methylpentoxy)oxane-3,4,5-triol, 4tms

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(2R,3S,4S,5R,6R)-2-(Hydroxymethyl)-6-(4-methylpentoxy)oxane-3,4,5-triol, 4tms
SpectraBase Compound ID HLS2UqzT7sB
InChI InChI=1S/C24H56O6Si4/c1-19(2)16-15-17-25-24-23(30-34(12,13)14)22(29-33(9,10)11)21(28-32(6,7)8)20(27-24)18-26-31(3,4)5/h19-24H,15-18H2,1-14H3/t20-,21-,22+,23-,24-/m1/s1
InChIKey OCDICCRRDLWRIN-GNADVCDUSA-N
Mol Weight 553.0 g/mol
Molecular Formula C24H56O6Si4
Exact Mass 552.315396 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LIG870WlYBd
Name (2R,3S,4S,5R,6R)-2-(Hydroxymethyl)-6-(4-methylpentoxy)oxane-3,4,5-triol, 4tms
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 552.315395657 u
Formula C24H56O6Si4
InChI InChI=1S/C24H56O6Si4/c1-19(2)16-15-17-25-24-23(30-34(12,13)14)22(29-33(9,10)11)21(28-32(6,7)8)20(27-24)18-26-31(3,4)5/h19-24H,15-18H2,1-14H3/t20-,21-,22+,23-,24-/m1/s1
InChIKey OCDICCRRDLWRIN-GNADVCDUSA-N
Molecular Weight 553.046 g/mol
SMILES C(O[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])CCC(C)C