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(E)-3-(3-Chlorophenyl)-2-fluoroacrylonitrile
SpectraBase Compound ID D02knirouru
InChI InChI=1S/C9H5ClFN/c10-8-3-1-2-7(4-8)5-9(11)6-12/h1-5H/b9-5+
InChIKey JVYPGOBKRZLGIQ-WEVVVXLNSA-N
Mol Weight 181.6 g/mol
Molecular Formula C9H5ClFN
Exact Mass 181.009455 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8vDAfsFOLe2
Name (E)-3-(3-Chlorophenyl)-2-fluoroacrylonitrile
Appearance Colorless liquid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H5ClFN
InChI InChI=1S/C9H5ClFN/c10-8-3-1-2-7(4-8)5-9(11)6-12/h1-5H/b9-5+
InChIKey JVYPGOBKRZLGIQ-WEVVVXLNSA-N
Ionization Type EI positive ion
Literature Reference DOI 10.1002/chem.201601483
Molecular Weight 181.597 g/mol
Quality 1000
Reported Formula C9H5ClFN
SMILES C1(\C=C/(F)C#N)=CC=CC(=C1)Cl
SPLASH splash10-001j-0900000000-f7f971d8e15bb6255332
Source of Spectrum QE-22-SM47-(E)-3p (DOI: 10.1002/chem.201601483)
Wiley ID 1904927