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2-[(2S)-2-(4-methoxyphenyl)-2-phenyl-ethyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
SpectraBase Compound ID LSdoAWDKfPu
InChI InChI=1S/C21H27BO3/c1-20(2)21(3,4)25-22(24-20)15-19(16-9-7-6-8-10-16)17-11-13-18(23-5)14-12-17/h6-14,19H,15H2,1-5H3/t19-/m0/s1
InChIKey JIKLIRKAUVTDIA-IBGZPJMESA-N
Mol Weight 338.3 g/mol
Molecular Formula C21H27BO3
Exact Mass 338.205325 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FiV4knjNWjn
Name 2-[(2S)-2-(4-methoxyphenyl)-2-phenyl-ethyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
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Formula C21H27BO3
GC Oven Program Oven temp 250oC
InChI InChI=1S/C21H27BO3/c1-20(2)21(3,4)25-22(24-20)15-19(16-9-7-6-8-10-16)17-11-13-18(23-5)14-12-17/h6-14,19H,15H2,1-5H3/t19-/m0/s1
InChIKey JIKLIRKAUVTDIA-IBGZPJMESA-N
Instrument Name Agilent 7890B-5977A
Ionization Type EI
Literature Reference DOI 10.1002/anie.201907185
Molecular Weight 338.254 g/mol
Reported Formula C21H27BO3
SMILES C1(C)(C)OB(C[C@](c2ccc(OC)cc2)(c2ccccc2)[H])OC1(C)C
SPLASH splash10-0002-1910000000-789c8fe20fb486ca249f
Source of Spectrum ACI-58-SM37-3n'
Wiley ID 1880177