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(4R,5R,1'R,2'R)-2-[2-{3-Tert-butyl(diphenyl)siloxypropyl}cyclopropyl]-4,5-bis[methoxy(diphenyl)methyl]-1,3.2-dioxaborolane

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(4R,5R,1'R,2'R)-2-[2-{3-Tert-butyl(diphenyl)siloxypropyl}cyclopropyl]-4,5-bis[methoxy(diphenyl)methyl]-1,3.2-dioxaborolane
SpectraBase Compound ID Db9bJO5VCFi
InChI InChI=1S/C52H57BO5Si/c1-49(2,3)37-45(38-24-12-6-13-25-38)52(58-59,43-34-22-11-23-35-43)44-36-46(44)53-56-47(50(54-4,39-26-14-7-15-27-39)40-28-16-8-17-29-40)48(57-53)51(55-5,41-30-18-9-19-31-41)42-32-20-10-21-33-42/h6-35,44-48H,36-37H2,1-5,59H3/t44-,45?,46-,47-,48-,52?/m1/s1
InChIKey SMSBYPKYAXSTGA-QIHHSSPASA-N
Mol Weight 800.9 g/mol
Molecular Formula C52H57BO5Si
Exact Mass 800.406832 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 77QpcYbHpwS
Name (4R,5R,1'R,2'R)-2-[2-{3-Tert-butyl(diphenyl)siloxypropyl}cyclopropyl]-4,5-bis[methoxy(diphenyl)methyl]-1,3.2-dioxaborolane
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 800.406831635 u
Formula C52H57BO5Si
InChI InChI=1S/C52H57BO5Si/c1-49(2,3)37-45(38-24-12-6-13-25-38)52(58-59,43-34-22-11-23-35-43)44-36-46(44)53-56-47(50(54-4,39-26-14-7-15-27-39)40-28-16-8-17-29-40)48(57-53)51(55-5,41-30-18-9-19-31-41)42-32-20-10-21-33-42/h6-35,44-48H,36-37H2,1-5,59H3/t44-,45?,46-,47-,48-,52?/m1/s1
InChIKey SMSBYPKYAXSTGA-QIHHSSPASA-N
Molecular Weight 800.918 g/mol
SMILES [C@@]1(B2O[C@@](C(C=3C=CC=CC3)(C3=CC=CC=C3)OC)([C@@](O2)(C(C=2C=CC=CC2)(C=2C=CC=CC2)OC)[H])[H])([C@](C(C(CC(C)(C)C)C=2C=CC=CC2)(C2=CC=CC=C2)O[SiH3])(C1)[H])[H]