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Ethyl 2-methyl-2-phenyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)propanoate
SpectraBase Compound ID FFQB33gR4Po
InChI InChI=1S/C18H27BO4/c1-7-21-15(20)18(6,14-11-9-8-10-12-14)13-19-22-16(2,3)17(4,5)23-19/h8-12H,7,13H2,1-6H3
InChIKey KLQOQESUMLZKEV-UHFFFAOYSA-N
Mol Weight 318.2 g/mol
Molecular Formula C18H27BO4
Exact Mass 318.20024 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3moMJYMtZi9
Name Ethyl 2-methyl-2-phenyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)propanoate
Appearance Colorless oil
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Formula C18H27BO4
InChI InChI=1S/C18H27BO4/c1-7-21-15(20)18(6,14-11-9-8-10-12-14)13-19-22-16(2,3)17(4,5)23-19/h8-12H,7,13H2,1-6H3
InChIKey KLQOQESUMLZKEV-UHFFFAOYSA-N
Instrument Name Agilent 7890A-5975C VL/5975 GC
Ionization Type EI
Literature Reference DOI 10.1021/acs.orglett.1c00617
Molecular Weight 318.220 g/mol
Reported Formula C18H27(10)BO4
SMILES c1cc(C(C)(C(OCC)=O)CB2OC(C(O2)(C)C)(C)C)ccc1
SPLASH splash10-000t-9750000000-04bff817885c5d742c99
Source of Spectrum A1-23-SM18-2b
Thin-Layer Chromatography Rf = 0.35 (silica, petroleum ether/ethyl acetate, 20:1)
Wiley ID 1868168