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2-(4'-Methylbiphenyl-4-ylsulfonyl)-4'-(trifluoromethane)biphenyl
SpectraBase Compound ID EfSN3RO6Ni9
InChI InChI=1S/C26H19F3O2S/c1-18-6-8-19(9-7-18)20-12-16-23(17-13-20)32(30,31)25-5-3-2-4-24(25)21-10-14-22(15-11-21)26(27,28)29/h2-17H,1H3
InChIKey USJVOGOVUHUCRT-UHFFFAOYSA-N
Mol Weight 452.49 g/mol
Molecular Formula C26H19F3O2S
Exact Mass 452.105786 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5weDCvsF14I
Name 2-(4'-Methylbiphenyl-4-ylsulfonyl)-4'-(trifluoromethane)biphenyl
Alternate Name(s) 2-((4'-methyl-[1,1'-biphenyl]-4-yl)sulfonyl)-4'-(trifluoromethyl)-1,1'-biphenyl
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Formula C26H19F3O2S
InChI InChI=1S/C26H19F3O2S/c1-18-6-8-19(9-7-18)20-12-16-23(17-13-20)32(30,31)25-5-3-2-4-24(25)21-10-14-22(15-11-21)26(27,28)29/h2-17H,1H3
InChIKey USJVOGOVUHUCRT-UHFFFAOYSA-N
Molecular Weight 452.491 g/mol
SMILES c1(c(cccc1)S(c1ccc(cc1)-c1ccc(cc1)C)(=O)=O)-c1ccc(cc1)C(F)(F)F
SPLASH splash10-0udi-0710900000-cc3579ce1c84b3de2bd1
Source of Spectrum CCC-4-356/SM8-6d
Wiley ID 1788883