2-(CYCLOHEXYLAMINO)-2-OXO-1-[4-(TRIFLUOROMETHYL)-PHENYL]-ETHYL-3-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)-BENZOATE

SpectraBase Compound ID	3DxWeimest8
InChI	InChI=1S/C28H33BF3NO5/c1-26(2)27(3,4)38-29(37-26)21-10-8-9-19(17-21)25(35)36-23(24(34)33-22-11-6-5-7-12-22)18-13-15-20(16-14-18)28(30,31)32/h8-10,13-17,22-23H,5-7,11-12H2,1-4H3,(H,33,34)
InChIKey	GEXDFRMUCZVCMU-UHFFFAOYSA-N Google Search
Mol Weight	531.4 g/mol
Molecular Formula	C28H33BF3NO5
Exact Mass	531.240388 g/mol

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SpectraBase Spectrum ID	A8rSOLS1FwX
Name	2-(CYCLOHEXYLAMINO)-2-OXO-1-[4-(TRIFLUOROMETHYL)-PHENYL]-ETHYL-3-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)-BENZOATE
Compound Number	A5
Copyright	Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula	C28H33BF3NO5
InChI	InChI=1S/C28H33BF3NO5/c1-26(2)27(3,4)38-29(37-26)21-10-8-9-19(17-21)25(35)36-23(24(34)33-22-11-6-5-7-12-22)18-13-15-20(16-14-18)28(30,31)32/h8-10,13-17,22-23H,5-7,11-12H2,1-4H3,(H,33,34)
InChIKey	GEXDFRMUCZVCMU-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	UWIR9066