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Ethyl 2-methyl-2-(pyridin-4-yl)-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)propanoate
SpectraBase Compound ID AC1lNkp4h31
InChI InChI=1S/C17H26BNO4/c1-7-21-14(20)17(6,13-8-10-19-11-9-13)12-18-22-15(2,3)16(4,5)23-18/h8-11H,7,12H2,1-6H3
InChIKey BCYGEHLGFCGFMU-UHFFFAOYSA-N
Mol Weight 319.2 g/mol
Molecular Formula C17H26BNO4
Exact Mass 319.195488 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6Cm6stnPjG0
Name Ethyl 2-methyl-2-(pyridin-4-yl)-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)propanoate
Appearance Colorless oil
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Formula C17H26BNO4
InChI InChI=1S/C17H26BNO4/c1-7-21-14(20)17(6,13-8-10-19-11-9-13)12-18-22-15(2,3)16(4,5)23-18/h8-11H,7,12H2,1-6H3
InChIKey BCYGEHLGFCGFMU-UHFFFAOYSA-N
Instrument Name Agilent 7890A-5975C VL/5975 GC
Ionization Type EI
Literature Reference DOI 10.1021/acs.orglett.1c00617
Molecular Weight 319.208 g/mol
Reported Formula C17H26(10)BNO4
SMILES c1cc(C(C)(C(OCC)=O)CB2OC(C(O2)(C)C)(C)C)ccn1
SPLASH splash10-01ot-0970000000-58e599a7d70e5d776d23
Source of Spectrum A1-23-SM24-2o
Thin-Layer Chromatography Rf = 0.35 (silica, petroleum ether/ethyl acetate, 2:1)
Wiley ID 1868180