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

*Links on SpectraBase are not permalinks.
4-{[(2-{[2'-Bromo-(1,1'-biphenyl)-3-yl]ethynyl}phenyl)-ethynyl]diisopropylsilyl}butanenitrile
SpectraBase Compound ID FQKirk2avBF
InChI InChI=1S/C32H32BrNSi/c1-25(2)35(26(3)4,22-10-9-21-34)23-20-29-14-6-5-13-28(29)19-18-27-12-11-15-30(24-27)31-16-7-8-17-32(31)33/h5-8,11-17,24-26H,9-10,22H2,1-4H3
InChIKey SBONFSDUSSGKJB-UHFFFAOYSA-N
Mol Weight 538.6 g/mol
Molecular Formula C32H32BrNSi
Exact Mass 537.14874 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 6PtMkAWejMh
Name 4-{[(2-{[2'-Bromo-(1,1'-biphenyl)-3-yl]ethynyl}phenyl)-ethynyl]diisopropylsilyl}butanenitrile
Appearance Brown oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 537.148739569 u
Formula C32H32BrNSi
InChI InChI=1S/C32H32BrNSi/c1-25(2)35(26(3)4,22-10-9-21-34)23-20-29-14-6-5-13-28(29)19-18-27-12-11-15-30(24-27)31-16-7-8-17-32(31)33/h5-8,11-17,24-26H,9-10,22H2,1-4H3
InChIKey SBONFSDUSSGKJB-UHFFFAOYSA-N
Instrument Name Waters Micromass AutoSpec Ultima
Ionization Type EI positive ion
Literature Reference DOI 10.1002/ejoc.201800586
Molecular Weight 538.604 g/mol
Quality 675
Reported Formula C32H32BrNSi
SMILES C1=CC(=CC(=C1)C1=C(C=CC=C1)Br)C#CC1=CC=CC=C1C#C[Si](C(C)C)(C(C)C)CCCC#N
SPLASH splash10-0005-0012900000-4194132801265a1a33ae
Source of Spectrum K1-2018-SM47-22 (DOI: 10.1002/ejoc.201800586)
Wiley ID 1896942