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3-Cyano-2-(4'-chlorophenyl)-6-(2'-pyridyl)-4-(trifluoromethyl)pyridine

View entire compound with spectra: 1 NMR, and 1 MS (GC)

3-Cyano-2-(4'-chlorophenyl)-6-(2'-pyridyl)-4-(trifluoromethyl)pyridine
SpectraBase Compound ID A3hQL0EbwIC
InChI InChI=1S/C18H9ClF3N3/c19-12-6-4-11(5-7-12)17-13(10-23)14(18(20,21)22)9-16(25-17)15-3-1-2-8-24-15/h1-9H
InChIKey BWUKUBLZBNSBTO-UHFFFAOYSA-N
Mol Weight 359.74 g/mol
Molecular Formula C18H9ClF3N3
Exact Mass 359.043709 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1ycKp43JIVZ
Name 3-Cyano-2-(4'-chlorophenyl)-6-(2'-pyridyl)-4-(trifluoromethyl)pyridine
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 359.043709491 u
Formula C18H9ClF3N3
InChI InChI=1S/C18H9ClF3N3/c19-12-6-4-11(5-7-12)17-13(10-23)14(18(20,21)22)9-16(25-17)15-3-1-2-8-24-15/h1-9H
InChIKey BWUKUBLZBNSBTO-UHFFFAOYSA-N
Molecular Weight 359.739 g/mol
SMILES C=1(C(=C(C=C(N1)C=1C=CC=CN1)C(F)(F)F)C#N)C=1C=CC(=CC1)Cl