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4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)benzoic acid

View entire compound with spectra: 3 NMR, 3 FTIR, 1 Raman, and 2 MS (GC)

4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)benzoic acid
SpectraBase Compound ID CEdVs6u7SyU
InChI InChI=1S/C13H17BO4/c1-12(2)13(3,4)18-14(17-12)10-7-5-9(6-8-10)11(15)16/h5-8H,1-4H3,(H,15,16)
InChIKey IYDKBQIEOBXLTP-UHFFFAOYSA-N
Mol Weight 248.1 g/mol
Molecular Formula C13H17BO4
Exact Mass 248.121989 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID BrLFE1s4Oo6
Name 4-Carboxylphenylboronic acid pinacol ester
Source of Sample Sigma-Aldrich Co. LLC.
Catalog Number 513490
CAS Registry Number 180516-87-4
Copyright Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H17BO4
InChI InChI=1S/C13H17BO4/c1-12(2)13(3,4)18-14(17-12)10-7-5-9(6-8-10)11(15)16/h5-8H,1-4H3,(H,15,16)
InChIKey IYDKBQIEOBXLTP-UHFFFAOYSA-N
Observed nucleus 13C
Purity 97%
Solvent CDCl3
Source of Spectrum Sigma-Aldrich Co. LLC.
Synonyms 4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)benzoic acid
Wiley ID SIAL_13CNMR_010352