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Methyl 2-methyl-2-phenyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)propanoate
SpectraBase Compound ID CoWwAtoEmcK
InChI InChI=1S/C17H25BO4/c1-15(2)16(3,4)22-18(21-15)12-17(5,14(19)20-6)13-10-8-7-9-11-13/h7-11H,12H2,1-6H3
InChIKey QXXGCKVKQBSFQB-UHFFFAOYSA-N
Mol Weight 304.2 g/mol
Molecular Formula C17H25BO4
Exact Mass 304.184589 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2DIkR06IwoW
Name Methyl 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 C17H25BO4
InChI InChI=1S/C17H25BO4/c1-15(2)16(3,4)22-18(21-15)12-17(5,14(19)20-6)13-10-8-7-9-11-13/h7-11H,12H2,1-6H3
InChIKey QXXGCKVKQBSFQB-UHFFFAOYSA-N
Instrument Name Agilent 7890A-5975C VL/5975 GC
Ionization Type EI
Literature Reference DOI 10.1021/acs.orglett.1c00617
Molecular Weight 304.193 g/mol
Reported Formula C17H25(10)BO4
SMILES c1cc(C(C)(C(OC)=O)CB2OC(C(O2)(C)C)(C)C)ccc1
SPLASH splash10-000t-9770000000-6bef11b1d24025542623
Source of Spectrum A1-23-SM17-2a
Thin-Layer Chromatography Rf = 0.35 (silica, petroleum ether/ethyl acetate, 20:1)
Wiley ID 1868167