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3,5-Dichloro-2-[4-(trifluoromethyl)phenyl]-4-(4-cyanophenyl)-6-p-tolylpyridine
SpectraBase Compound ID 9L3sUx784AY
InChI InChI=1S/C26H15Cl2F3N2/c1-15-2-6-18(7-3-15)24-22(27)21(17-8-4-16(14-32)5-9-17)23(28)25(33-24)19-10-12-20(13-11-19)26(29,30)31/h2-13H,1H3
InChIKey XGXCKSCXXLAUIR-UHFFFAOYSA-N
Mol Weight 483.32 g/mol
Molecular Formula C26H15Cl2F3N2
Exact Mass 482.056438 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3CEmF3ad89K
Name 3,5-Dichloro-2-[4-(trifluoromethyl)phenyl]-4-(4-cyanophenyl)-6-p-tolylpyridine
Appearance White solid
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Exact Mass 482.056438380 u
Formula C26H15Cl2F3N2
InChI InChI=1S/C26H15Cl2F3N2/c1-15-2-6-18(7-3-15)24-22(27)21(17-8-4-16(14-32)5-9-17)23(28)25(33-24)19-10-12-20(13-11-19)26(29,30)31/h2-13H,1H3
InChIKey XGXCKSCXXLAUIR-UHFFFAOYSA-N
Ionization Type EI
Literature Reference DOI 10.1002/ejoc.201701718
Molecular Weight 483.321 g/mol
Reported Formula C26H15Cl2F3N2
SMILES C=1(Cl)C(=C(C(=NC1C1=CC=C(C=C1)C)C1=CC=C(C=C1)C(F)(F)F)Cl)C1=CC=C(C=C1)C#N
SPLASH splash10-001i-0000900000-19a0697baf0c0ec49317
Source of Spectrum K1-2018-1001-10c (DOI: 10.1002/ejoc.201701718)
Wiley ID 1891805