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4,4,5,5-Tetramethyl-2-(4-octadecyloxy-phenyl)-[1,3,2]dioxaborolane

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4,4,5,5-Tetramethyl-2-(4-octadecyloxy-phenyl)-[1,3,2]dioxaborolane
SpectraBase Compound ID D6HUZKD7At5
InChI InChI=1S/C30H53BO3/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-26-32-28-24-22-27(23-25-28)31-33-29(2,3)30(4,5)34-31/h22-25H,6-21,26H2,1-5H3
InChIKey FCVBPCNSCRVSDA-UHFFFAOYSA-N
Mol Weight 472.6 g/mol
Molecular Formula C30H53BO3
Exact Mass 472.408776 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4l5Yz9C1GHi
Name 4,4,5,5-Tetramethyl-2-(4-octadecyloxy-phenyl)-[1,3,2]dioxaborolane
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 472.408775734 u
Formula C30H53BO3
InChI InChI=1S/C30H53BO3/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-26-32-28-24-22-27(23-25-28)31-33-29(2,3)30(4,5)34-31/h22-25H,6-21,26H2,1-5H3
InChIKey FCVBPCNSCRVSDA-UHFFFAOYSA-N
Molecular Weight 472.561 g/mol
SMILES C1=CC(B2OC(C(C)(C)O2)(C)C)=CC=C1OCCCCCCCCCCCCCCCCCC