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5-Fluoro-2-nitrobenzonitriile
SpectraBase Compound ID 6zhWH28S9UY
InChI InChI=1S/C7H3FN2O2/c8-6-1-2-7(10(11)12)5(3-6)4-9/h1-3H
InChIKey VCEQYKYTIDJWTD-UHFFFAOYSA-N
Mol Weight 166.11 g/mol
Molecular Formula C7H3FN2O2
Exact Mass 166.017856 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8KFRx62L7aq
Name 5-Fluoro-2-nitrobenzonitriile
Classification Chemical
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 166.017855506 u
Formula C7H3FN2O2
InChI InChI=1S/C7H3FN2O2/c8-6-1-2-7(10(11)12)5(3-6)4-9/h1-3H
InChIKey VCEQYKYTIDJWTD-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 166.111 g/mol
Nominal Mass 166 u
Quality 939
Retention Index 1288
SMILES C=1(C([N+](=O)[O-])=CC=C(C1)F)C#N
SPLASH splash10-001i-9400000000-6c020009ed6490fc5959
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms 5-fluoro-2-nitrobenzonitrile
Technique GC/MS
Wiley ID DD2024_005520