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(2E,4Z)-5-(4-Cyanophenyl)-3-(trifluoromethyl)penta-2,4-dienenitrile
SpectraBase Compound ID Ey4LwPo1oRc
InChI InChI=1S/C13H7F3N2/c14-13(15,16)12(7-8-17)6-5-10-1-3-11(9-18)4-2-10/h1-7H/b6-5-,12-7+
InChIKey CVEFPALYNHYWBI-UNKATYBDSA-N
Mol Weight 248.21 g/mol
Molecular Formula C13H7F3N2
Exact Mass 248.056133 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7ojtO0fE7nv
Name (2E,4Z)-5-(4-Cyanophenyl)-3-(trifluoromethyl)penta-2,4-dienenitrile
Appearance White solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H7F3N2
InChI InChI=1S/C13H7F3N2/c14-13(15,16)12(7-8-17)6-5-10-1-3-11(9-18)4-2-10/h1-7H/b6-5-,12-7+
InChIKey CVEFPALYNHYWBI-UNKATYBDSA-N
Instrument Name HRMS
Ionization Type EI
Literature Reference DOI 10.1021/acs.orglett.1c01988
Molecular Weight 248.208 g/mol
Reported Formula C13H7F3N2
SMILES C(\C=C/(\C=C/c1ccc(cc1)C#N)C(F)(F)F)#N
SPLASH splash10-004i-0940000000-6af3c9a6016481269a71
Source of Spectrum A1-23-SM138-(2E,4Z)-5p
Wiley ID 1870228