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3,5-Dichloro-2,6-bis(phenylethynyl)-4-(4-(trifluoromethyl)-phenyl)pyridine

View entire compound with spectra: 1 MS (GC)

3,5-Dichloro-2,6-bis(phenylethynyl)-4-(4-(trifluoromethyl)-phenyl)pyridine
SpectraBase Compound ID Cb4CanF7cVM
InChI InChI=1S/C28H14Cl2F3N/c29-26-23(17-11-19-7-3-1-4-8-19)34-24(18-12-20-9-5-2-6-10-20)27(30)25(26)21-13-15-22(16-14-21)28(31,32)33/h1-10,13-16H
InChIKey ZURRUGKKYGHFRM-UHFFFAOYSA-N
Mol Weight 492.33 g/mol
Molecular Formula C28H14Cl2F3N
Exact Mass 491.045539 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID I8HV8QeQp99
Name 3,5-Dichloro-2,6-bis(phenylethynyl)-4-(4-(trifluoromethyl)-phenyl)pyridine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H14Cl2F3N
InChI InChI=1S/C28H14Cl2F3N/c29-26-23(17-11-19-7-3-1-4-8-19)34-24(18-12-20-9-5-2-6-10-20)27(30)25(26)21-13-15-22(16-14-21)28(31,32)33/h1-10,13-16H
InChIKey ZURRUGKKYGHFRM-UHFFFAOYSA-N
Literature Reference DOI 10.1039/c4ob01292e
Molecular Weight 492.328 g/mol
SMILES c1(c(c(c(C#Cc2ccccc2)nc1C#Cc1ccccc1)Cl)-c1ccc(cc1)C(F)(F)F)Cl
SPLASH splash10-0006-0010900000-2f3c7a2e85196b5cf1b6
Source of Spectrum F5-12-8635-8a
Synonyms 3,5-Dichloro-2,6-bis(phenylethynyl)-4-(4-(trifluoromethyl)phenyl)pyridine
Wiley ID 1748281