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1,4-Bis(m-tolylethynyl)-2-(trifluoromethyl)benzene
SpectraBase Compound ID JGcTyMr1SnF
InChI InChI=1S/C25H17F3/c1-18-5-3-7-20(15-18)9-10-22-12-14-23(24(17-22)25(26,27)28)13-11-21-8-4-6-19(2)16-21/h3-8,12,14-17H,1-2H3
InChIKey VVPFRFZDZQGNGG-UHFFFAOYSA-N
Mol Weight 374.41 g/mol
Molecular Formula C25H17F3
Exact Mass 374.128235 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID D1nmLACRovI
Name 1,4-Bis(m-tolylethynyl)-2-(trifluoromethyl)benzene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H17F3
InChI InChI=1S/C25H17F3/c1-18-5-3-7-20(15-18)9-10-22-12-14-23(24(17-22)25(26,27)28)13-11-21-8-4-6-19(2)16-21/h3-8,12,14-17H,1-2H3
InChIKey VVPFRFZDZQGNGG-UHFFFAOYSA-N
Molecular Weight 374.406 g/mol
SMILES C(c1c(C#Cc2cc(C)ccc2)ccc(C#Cc2cc(C)ccc2)c1)(F)(F)F
SPLASH splash10-00di-0009000000-1bd6028e38c0ba3031c3
Source of Spectrum U1-2013-8131-4k
Synonyms 3,3'-((2-(trifluoromethyl)-1,4-phenylene)bis(ethyne-2,1-diyl))bis(methylbenzene)
Wiley ID 1740413