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2-(CYCLOHEXYLAMINO)-2-OXO-1-(PYRIDIN-3-YL)-ETHYL-3-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)-BENZOATE
SpectraBase Compound ID 5NHkvrt8511
InChI InChI=1S/C26H33BN2O5/c1-25(2)26(3,4)34-27(33-25)20-12-8-10-18(16-20)24(31)32-22(19-11-9-15-28-17-19)23(30)29-21-13-6-5-7-14-21/h8-12,15-17,21-22H,5-7,13-14H2,1-4H3,(H,29,30)
InChIKey OCTNFADNYZZQOA-UHFFFAOYSA-N
Mol Weight 464.4 g/mol
Molecular Formula C26H33BN2O5
Exact Mass 464.248252 g/mol

11B Nuclear Magnetic Resonance (NMR) Chemical Shifts

11B Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DVbJlskTHyw
Name 2-(CYCLOHEXYLAMINO)-2-OXO-1-(PYRIDIN-3-YL)-ETHYL-3-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)-BENZOATE
Compound Number A17
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C26H33BN2O5
InChI InChI=1S/C26H33BN2O5/c1-25(2)26(3,4)34-27(33-25)20-12-8-10-18(16-20)24(31)32-22(19-11-9-15-28-17-19)23(30)29-21-13-6-5-7-14-21/h8-12,15-17,21-22H,5-7,13-14H2,1-4H3,(H,29,30)
InChIKey OCTNFADNYZZQOA-UHFFFAOYSA-N
Literature Reference Author C.C.CHAI,P.Y.LIU,C.H.LIN,H.C.CHEN,Y.C.WU,F.R.CHANG,P.S.PAN
Literature Reference Citation MOLECULES,18,9488(2013)
Literature Reference DOI 10.3390/molecules18089488
Solvent CDCl3
Source File Reference UWIR9078