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(E)-3-(2-Chlorophenyl)-2-fluoroacrylonitrile
SpectraBase Compound ID 98BL6haq0ck
InChI InChI=1S/C9H5ClFN/c10-9-4-2-1-3-7(9)5-8(11)6-12/h1-5H/b8-5+
InChIKey QAIGJKMQUSOFQU-VMPITWQZSA-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 4EeM6fzJHk
Name (E)-3-(2-Chlorophenyl)-2-fluoroacrylonitrile
Appearance Colorless liquid
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Formula C9H5ClFN
InChI InChI=1S/C9H5ClFN/c10-9-4-2-1-3-7(9)5-8(11)6-12/h1-5H/b8-5+
InChIKey QAIGJKMQUSOFQU-VMPITWQZSA-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=C1Cl
SPLASH splash10-001j-1900000000-a5a8444cd6b7f17f9e3f
Source of Spectrum QE-22-SM49-(E)-3q (DOI: 10.1002/chem.201601483)
Wiley ID 1904928