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2-(4-{2-[(trifluoromethyl)selanyl]ethynyl}phenyl)acetonitrile
SpectraBase Compound ID HlAhRrDCq0e
InChI InChI=1S/C11H6F3NSe/c12-11(13,14)16-8-6-10-3-1-9(2-4-10)5-7-15/h1-4H,5H2
InChIKey IZKRSIPZMXMIES-UHFFFAOYSA-N
Mol Weight 288.14 g/mol
Molecular Formula C11H6F3NSe
Exact Mass 288.961756 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID I8hjIJ4EYqA
Name 2-(4-{2-[(trifluoromethyl)selanyl]ethynyl}phenyl)acetonitrile
Appearance Yellow solid
Carrier Gas Helium
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Exact Mass 288.961755686 u
Formula C11H6F3NSe
GC Column HP-5 (30 m x 0.25 mm, film thickness 0.25 micrometer)
InChI InChI=1S/C11H6F3NSe/c12-11(13,14)16-8-6-10-3-1-9(2-4-10)5-7-15/h1-4H,5H2
InChIKey IZKRSIPZMXMIES-UHFFFAOYSA-N
Instrument Name Agilent HP-5890-Agilent HP-5973
Ionization Type EI
Literature Reference DOI 10.1002/chem.201702028
Molecular Weight 288.143 g/mol
Quality 569
Reported Formula C11H6F3NSe
SMILES C([Se]C#CC=1C=CC(=CC1)CC#N)(F)(F)F
SPLASH splash10-00y3-1390000000-8eaeb83389510ffaf50d
Source of Spectrum QE-23-SM4-2e (DOI: 10.1002/chem.201702028)
Wiley ID 1905588