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4-Cyanobiphenyl
SpectraBase Compound ID IuvMuFcfUqU
InChI InChI=1S/C13H9N/c14-10-11-6-8-13(9-7-11)12-4-2-1-3-5-12/h1-9H
InChIKey BPMBNLJJRKCCRT-UHFFFAOYSA-N
Mol Weight 179.22 g/mol
Molecular Formula C13H9N
Exact Mass 179.073499 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JBBnfVofAGe
Name Biphenyl-4-carbonitrile
Appearance White solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 179.073499294 u
Formula C13H9N
InChI InChI=1S/C13H9N/c14-10-11-6-8-13(9-7-11)12-4-2-1-3-5-12/h1-9H
InChIKey BPMBNLJJRKCCRT-UHFFFAOYSA-N
Ionization Type EI
Literature Reference DOI 10.1021/jo3018878
Molecular Weight 179.222 g/mol
Quality 218
SMILES C1=CC(=CC=C1C#N)C1=CC=CC=C1
SPLASH splash10-004i-0900000000-e20f2b9b8141a53b236c
Source of Spectrum JOC-78-1930-6b (DOI: 10.1021/jo3018878)
Wiley ID 1912334