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2-{4-[(4-Methoxyphenyl)ethynyl]phenyl}-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
SpectraBase Compound ID HOUEmk1eyYX
InChI InChI=1S/C21H23BO3/c1-20(2)21(3,4)25-22(24-20)18-12-8-16(9-13-18)6-7-17-10-14-19(23-5)15-11-17/h8-15H,1-5H3
InChIKey RRYKLXOOBFDYDY-UHFFFAOYSA-N
Mol Weight 334.2 g/mol
Molecular Formula C21H23BO3
Exact Mass 334.174025 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B0aoaJpTdcA
Name 2-{4-[(4-Methoxyphenyl)ethynyl]phenyl}-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
Appearance White solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H23BO3
InChI InChI=1S/C21H23BO3/c1-20(2)21(3,4)25-22(24-20)18-12-8-16(9-13-18)6-7-17-10-14-19(23-5)15-11-17/h8-15H,1-5H3
InChIKey RRYKLXOOBFDYDY-UHFFFAOYSA-N
Instrument Name Agilent 6890N-5973
Ionization Type EI
Literature Reference DOI 10.3762/bjoc.5.11
Molecular Weight 334.222 g/mol
SMILES c1(B2OC(C(O2)(C)C)(C)C)ccc(cc1)C#Cc1ccc(cc1)OC
SPLASH splash10-001i-0298000000-ebec8ea17418d6d649b2
Source of Spectrum BJO-5-SM9-6b
Thin-Layer Chromatography Rf = 0.70 (silica gel; hexane/EtOAc, 4:1)
Wiley ID 1871555