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4-Fluorobenzonitrile

View entire compound with spectra: 20 NMR, 6 FTIR, 2 Raman, and 7 MS (GC)

4-Fluorobenzonitrile
SpectraBase Compound ID 40xbcNiAGd4
InChI InChI=1S/C7H4FN/c8-7-3-1-6(5-9)2-4-7/h1-4H
InChIKey AEKVBBNGWBBYLL-UHFFFAOYSA-N
Mol Weight 121.11 g/mol
Molecular Formula C7H4FN
Exact Mass 121.032777 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2lMSHG5p7yu
Name 4-FLUOROBENZENECARBONITRILE
CAS Registry Number 24075-34-1
Compound Number 30
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C7H4FN
InChI InChI=1S/C7H4FN/c8-7-3-1-6(5-9)2-4-7/h1-4H
InChIKey AEKVBBNGWBBYLL-UHFFFAOYSA-N
Literature Reference Author F.J.WEIGERT,W.A.SHEPPARD
Literature Reference Citation J.ORG.CHEM.,41,4006(1976)
Literature Reference DOI 10.1021/jo00887a017
Solvent CH3CN
Source File Reference UWCS18017