For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

4-(4-Methoxyphenyl)-5-[4-(trifluoromethyl)phenyl]-2,3,6-tri-para-tolylpyridine

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

4-(4-Methoxyphenyl)-5-[4-(trifluoromethyl)phenyl]-2,3,6-tri-para-tolylpyridine
SpectraBase Compound ID CX3Kj7fFZvq
InChI InChI=1S/C40H32F3NO/c1-25-5-11-29(12-6-25)36-35(28-19-23-34(45-4)24-20-28)37(30-17-21-33(22-18-30)40(41,42)43)39(32-15-9-27(3)10-16-32)44-38(36)31-13-7-26(2)8-14-31/h5-24H,1-4H3
InChIKey CYUHKHZVYANVDX-UHFFFAOYSA-N
Mol Weight 599.7 g/mol
Molecular Formula C40H32F3NO
Exact Mass 599.243599 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

Subscribe to view the full spectrum.

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID Cx8G2mZ6nyV
Name 4-(4-Methoxyphenyl)-5-[4-(trifluoromethyl)phenyl]-2,3,6-tri-para-tolylpyridine
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 599.243599142 u
Formula C40H32F3NO
InChI InChI=1S/C40H32F3NO/c1-25-5-11-29(12-6-25)36-35(28-19-23-34(45-4)24-20-28)37(30-17-21-33(22-18-30)40(41,42)43)39(32-15-9-27(3)10-16-32)44-38(36)31-13-7-26(2)8-14-31/h5-24H,1-4H3
InChIKey CYUHKHZVYANVDX-UHFFFAOYSA-N
Molecular Weight 599.697 g/mol
SMILES C=1(N=C(C(=C(C1C1=CC=C(C=C1)C)C1=CC=C(OC)C=C1)C1=CC=C(C(F)(F)F)C=C1)C1=CC=C(C)C=C1)C=1C=CC(C)=CC1