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6,8-Dioxabicyclo[3.2.1]octane, dl-threo-.alpha.-ld-galacto-octopyranose deriv.
SpectraBase Compound ID HG8ZcAcY81E
InChI InChI=1S/C27H42O9Si/c1-25(2,3)37(8,9)36-21-20(30-23(29)16-13-11-10-12-14-16)19(18-17(15-28)32-26(4,5)33-18)31-24-22(21)34-27(6,7)35-24/h10-14,17-22,24,28H,15H2,1-9H3/t17?,18?,19-,20+,21+,22-,24-/m1/s1
InChIKey WNQNVHYUCZJGMA-DZGIWXGBSA-N
Mol Weight 538.7 g/mol
Molecular Formula C27H42O9Si
Exact Mass 538.259809 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ErW6vqqR69i
Name 6,8-Dioxabicyclo[3.2.1]octane, dl-threo-.alpha.-ld-galacto-octopyranose deriv.
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 538.259809458 u
Formula C27H42O9Si
InChI InChI=1S/C27H42O9Si/c1-25(2,3)37(8,9)36-21-20(30-23(29)16-13-11-10-12-14-16)19(18-17(15-28)32-26(4,5)33-18)31-24-22(21)34-27(6,7)35-24/h10-14,17-22,24,28H,15H2,1-9H3/t17?,18?,19-,20+,21+,22-,24-/m1/s1
InChIKey WNQNVHYUCZJGMA-DZGIWXGBSA-N
Molecular Weight 538.709 g/mol
SMILES [C@]1([C@]([C@@](C2OC(C)(C)OC2CO)(O[C@]2([C@@]1(OC(C)(C)O2)[H])[H])[H])(OC(=O)C1=CC=CC=C1)[H])(O[Si](C(C)(C)C)(C)C)[H]