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DI-(4-TERT.-OCTYLPHENOXY)-PENTAERYTHRITYL-DI-[OXYCARBONYL-4-[4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL]-BENZENE]
SpectraBase Compound ID JA0GQhRvkwb
InChI InChI=1S/C59H82B2O10/c1-51(2,3)35-53(7,8)43-23-31-47(32-24-43)64-37-59(38-65-48-33-25-44(26-34-48)54(9,10)36-52(4,5)6,39-66-49(62)41-19-27-45(28-20-41)60-68-55(11,12)56(13,14)69-60)40-67-50(63)42-21-29-46(30-22-42)61-70-57(15,16)58(17,18)71-61/h19-34H,35-40H2,1-18H3
InChIKey WIOIFWOSFYEAAY-UHFFFAOYSA-N
Mol Weight 972.9 g/mol
Molecular Formula C59H82B2O10
Exact Mass 972.609409 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7TovMk09P7A
Name DI-(4-TERT.-OCTYLPHENOXY)-PENTAERYTHRITYL-DI-[OXYCARBONYL-4-[4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL]-BENZENE]
Compound Number 9
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C59H82B2O10
InChI InChI=1S/C59H82B2O10/c1-51(2,3)35-53(7,8)43-23-31-47(32-24-43)64-37-59(38-65-48-33-25-44(26-34-48)54(9,10)36-52(4,5)6,39-66-49(62)41-19-27-45(28-20-41)60-68-55(11,12)56(13,14)69-60)40-67-50(63)42-21-29-46(30-22-42)61-70-57(15,16)58(17,18)71-61/h19-34H,35-40H2,1-18H3
InChIKey WIOIFWOSFYEAAY-UHFFFAOYSA-N
Literature Reference Author S.P.DRAFFIN,P.J.DUGGAN,S.A.M.DUGGAN
Literature Reference Citation ORG.LETTERS,3,917(2001)
Literature Reference DOI 10.1021/ol015560x
Molecular Weight 972.914 g/mol
Solvent CDCl3
Source File Reference UWLU33759