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(2R,3S,4R)-4-Tert-butyldimethylsilyloxy-2,3-o-isopropylidenedodec-6-ene-1,2,3-triol
SpectraBase Compound ID 3DaLWoBIRYw
InChI InChI=1S/C21H42O4Si/c1-9-10-11-12-13-14-15-17(25-26(7,8)20(2,3)4)19-18(16-22)23-21(5,6)24-19/h13-14,17-19,22H,9-12,15-16H2,1-8H3/b14-13+/t17-,18-,19-/m1/s1
InChIKey BQGLHTOURSVOHS-RXDJHMODSA-N
Mol Weight 386.6 g/mol
Molecular Formula C21H42O4Si
Exact Mass 386.285236 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2kquANuvQTH
Name (2R,3S,4R)-4-Tert-butyldimethylsilyloxy-2,3-o-isopropylidenedodec-6-ene-1,2,3-triol
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 386.285236363 u
Formula C21H42O4Si
InChI InChI=1S/C21H42O4Si/c1-9-10-11-12-13-14-15-17(25-26(7,8)20(2,3)4)19-18(16-22)23-21(5,6)24-19/h13-14,17-19,22H,9-12,15-16H2,1-8H3/b14-13+/t17-,18-,19-/m1/s1
InChIKey BQGLHTOURSVOHS-RXDJHMODSA-N
Molecular Weight 386.648 g/mol
SMILES [C@]1(OC(C)(C)O[C@@]1(CO)[H])([C@](O[Si](C(C)(C)C)(C)C)(C\C=C\CCCCC)[H])[H]