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Methyl 3'-Hydroxy-4-[2-(trifluoromethanesulfonyloxy)benzoyl]biphenyl-2-carboxylate
SpectraBase Compound ID CFJrQgjPRZM
InChI InChI=1S/C22H15F3O7S/c1-31-21(28)18-12-14(9-10-16(18)13-5-4-6-15(26)11-13)20(27)17-7-2-3-8-19(17)32-33(29,30)22(23,24)25/h2-12,26H,1H3
InChIKey PGIBZCDFJIDAKI-UHFFFAOYSA-N
Mol Weight 480.41 g/mol
Molecular Formula C22H15F3O7S
Exact Mass 480.049058 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Faa6zzp0GjP
Name Methyl 3'-Hydroxy-4-[2-(trifluoromethanesulfonyloxy)benzoyl]biphenyl-2-carboxylate
Alternate Name(s) 2-(3-hydroxyphenyl)-5-[oxo-[2-(trifluoromethylsulfonyloxy)phenyl]methyl]benzoic acid methyl ester Methyl 2-(3-hydroxyphenyl)-5-[2-(trifluoromethylsulfonyloxy)benzoyl]benzoate Methyl 2-(3-hydroxyphenyl)-5-[2-(trifluoromethylsulfonyloxy)phenyl]carbonyl-benzoate
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Formula C22H15F3O7S
InChI InChI=1S/C22H15F3O7S/c1-31-21(28)18-12-14(9-10-16(18)13-5-4-6-15(26)11-13)20(27)17-7-2-3-8-19(17)32-33(29,30)22(23,24)25/h2-12,26H,1H3
InChIKey PGIBZCDFJIDAKI-UHFFFAOYSA-N
Molecular Weight 480.410 g/mol
SMILES Oc1cc(-c2ccc(C(c3c(OS(C(F)(F)F)(=O)=O)cccc3)=O)cc2C(=O)OC)ccc1
SPLASH splash10-05fr-3894800000-77a562a2cd7bee9bfa87
Source of Spectrum U1-2011-6679-6h
Wiley ID 1702850