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3-Chloro-2,5,6-tri-para-tolyl-4-[4-(trifluoromethyl)phenyl]pyridine
SpectraBase Compound ID G7LbTyEqHO8
InChI InChI=1S/C33H25ClF3N/c1-20-4-10-24(11-5-20)29-28(23-16-18-27(19-17-23)33(35,36)37)30(34)32(26-14-8-22(3)9-15-26)38-31(29)25-12-6-21(2)7-13-25/h4-19H,1-3H3
InChIKey VEGGQWFKWAYHBB-UHFFFAOYSA-N
Mol Weight 528.0 g/mol
Molecular Formula C33H25ClF3N
Exact Mass 527.162762 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GKkDhsn9MAF
Name 3-Chloro-2,5,6-tri-para-tolyl-4-[4-(trifluoromethyl)phenyl]pyridine
Alternate Name(s) 3-Chloro-2,5,6-tri-p-tolyl-4-(4-(trifluoromethyl)phenyl)pyridine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C33H25ClF3N
InChI InChI=1S/C33H25ClF3N/c1-20-4-10-24(11-5-20)29-28(23-16-18-27(19-17-23)33(35,36)37)30(34)32(26-14-8-22(3)9-15-26)38-31(29)25-12-6-21(2)7-13-25/h4-19H,1-3H3
InChIKey VEGGQWFKWAYHBB-UHFFFAOYSA-N
Literature Reference DOI 10.1002/adsc.201400164
Molecular Weight 528.018 g/mol
SMILES c1(nc(-c2ccc(cc2)C)c(c(c1-c1ccc(cc1)C)-c1ccc(C(F)(F)F)cc1)Cl)-c1ccc(cc1)C
SPLASH splash10-004i-0000090000-88fb66db97309e438d45
Source of Spectrum ASC-356-2003-11b
Wiley ID 1762219