For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
2-Methyl-2-phenyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)propanenitrile
SpectraBase Compound ID H4g6oRI3FaJ
InChI InChI=1S/C16H22BNO2/c1-14(2)15(3,4)20-17(19-14)11-16(5,12-18)13-9-7-6-8-10-13/h6-10H,11H2,1-5H3
InChIKey VHFIWHBMIKCXFK-UHFFFAOYSA-N
Mol Weight 271.2 g/mol
Molecular Formula C16H22BNO2
Exact Mass 271.174359 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 4FDGVwYyCsh
Name 2-Methyl-2-phenyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)propanenitrile
Appearance Colorless oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H22BNO2
InChI InChI=1S/C16H22BNO2/c1-14(2)15(3,4)20-17(19-14)11-16(5,12-18)13-9-7-6-8-10-13/h6-10H,11H2,1-5H3
InChIKey VHFIWHBMIKCXFK-UHFFFAOYSA-N
Instrument Name Agilent 7890A-5975C VL/5975 GC
Ionization Type EI
Literature Reference DOI 10.1021/acs.orglett.1c00617
Reported Formula C16H22(10)BNO2
SMILES c1cc(C(CB2OC(C)(C)C(C)(C)O2)(C#N)C)ccc1
SPLASH splash10-0a4j-0390000000-fe4b032b12a6a0231a1a
Source of Spectrum A1-23-SM27-2w
Thin-Layer Chromatography Rf = 0.35 (silica, petroleum ether/ethyl acetate, 10:1)
Wiley ID 1868187