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4-(4-(Trifluoromethyl)phenyl)-2,3,5,6-tetrakis((4-methoxyphenyl) ethynyl)pyridine
SpectraBase Compound ID gpsd3dhLYN
InChI InChI=1S/C48H32F3NO4/c1-53-39-21-5-33(6-22-39)13-29-43-45(31-15-35-9-25-41(55-3)26-10-35)52-46(32-16-36-11-27-42(56-4)28-12-36)44(30-14-34-7-23-40(54-2)24-8-34)47(43)37-17-19-38(20-18-37)48(49,50)51/h5-12,17-28H,1-4H3
InChIKey OKZCJDLIJSQCIC-UHFFFAOYSA-N
Mol Weight 743.8 g/mol
Molecular Formula C48H32F3NO4
Exact Mass 743.228343 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FhGSXqp7yP5
Name 4-(4-(Trifluoromethyl)phenyl)-2,3,5,6-tetrakis((4-methoxyphenyl) ethynyl)pyridine
Alternate Name(s) 2,3,5,6-tetrakis((4-methoxyphenyl)ethynyl)-4-(4-(trifluoromethyl)phenyl)pyridine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C48H32F3NO4
InChI InChI=1S/C48H32F3NO4/c1-53-39-21-5-33(6-22-39)13-29-43-45(31-15-35-9-25-41(55-3)26-10-35)52-46(32-16-36-11-27-42(56-4)28-12-36)44(30-14-34-7-23-40(54-2)24-8-34)47(43)37-17-19-38(20-18-37)48(49,50)51/h5-12,17-28H,1-4H3
InChIKey OKZCJDLIJSQCIC-UHFFFAOYSA-N
Literature Reference DOI 10.1039/c4ob01292e
Molecular Weight 743.782 g/mol
SMILES c1(C#Cc2ccc(cc2)OC)c(-c2ccc(C(F)(F)F)cc2)c(c(C#Cc2ccc(cc2)OC)nc1C#Cc1ccc(cc1)OC)C#Cc1ccc(cc1)OC
SPLASH splash10-0006-2002000900-12ceed2d50add2864e22
Source of Spectrum F5-12-8637-11b
Wiley ID 1748272