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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 8L8YHxVH7Sy
Name p-Phenylbenzonitrile
CAS Registry Number 2920-38-9
Classification Chemical
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. 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 Electron Ionization (EI)
Molecular Weight 179.222 g/mol
Nominal Mass 179 u
Quality 833
Retention Index 1402
SMILES C=1(C2=CC=CC=C2)C=CC(=CC1)C#N
SPLASH splash10-004i-2900000000-0cd5b8641bb04e377859
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms [1,1'-biphenyl]-4-carbonitrile
Technique GC/MS
Wiley ID DD2024_004330