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(+)-Pinacol (+-)-1-benzamido-1-phenylmethaneboronate

View entire compound with spectra: 1 NMR, and 1 MS (GC)

(+)-Pinacol (+-)-1-benzamido-1-phenylmethaneboronate
SpectraBase Compound ID ByQeOCwzHTG
InChI InChI=1S/C20H24BNO3/c1-19(2)20(3,4)25-21(24-19)17(15-11-7-5-8-12-15)22-18(23)16-13-9-6-10-14-16/h5-14,17H,1-4H3,(H,22,23)
InChIKey PDNUTDSQGPOQHR-UHFFFAOYSA-N
Mol Weight 337.2 g/mol
Molecular Formula C20H24BNO3
Exact Mass 337.184924 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AlOhvBqAMRw
Name (+)-pinacol (+-)-1-benzamido-1-phenylmethaneboronate
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 337.184923804 u
Formula C20H24BNO3
InChI InChI=1S/C20H24BNO3/c1-19(2)20(3,4)25-21(24-19)17(15-11-7-5-8-12-15)22-18(23)16-13-9-6-10-14-16/h5-14,17H,1-4H3,(H,22,23)
InChIKey PDNUTDSQGPOQHR-UHFFFAOYSA-N
Molecular Weight 337.226 g/mol
SMILES C1(OB(OC1(C)C)C(NC(=O)C=1C=CC=CC1)C=1C=CC=CC1)(C)C