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7-(3,5-Dimethylphenyl)-4-oxo-2-phenyl-4H-chromen-5-yl Trifluoromethanesulfonate
SpectraBase Compound ID K6TJmkNy4sZ
InChI InChI=1S/C24H17F3O5S/c1-14-8-15(2)10-17(9-14)18-11-21-23(22(12-18)32-33(29,30)24(25,26)27)19(28)13-20(31-21)16-6-4-3-5-7-16/h3-13H,1-2H3
InChIKey LCDCGKGDXDMMDU-UHFFFAOYSA-N
Mol Weight 474.45 g/mol
Molecular Formula C24H17F3O5S
Exact Mass 474.074879 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HFVBLEGwVVv
Name 7-(3,5-Dimethylphenyl)-4-oxo-2-phenyl-4H-chromen-5-yl Trifluoromethanesulfonate
Alternate Name(s) Trifluoromethanesulfonic acid [7-(3,5-dimethylphenyl)-4-oxo-2-phenyl-1-benzopyran-5-yl] ester [7-(3,5-dimethylphenyl)-4-oxo-2-phenylchromen-5-yl] trifluoromethanesulfonate [7-(3,5-dimethylphenyl)-4-oxo-2-phenyl-chromen-5-yl] trifluoromethanesulfonate [7-(3,5-dimethylphenyl)-4-oxidanylidene-2-phenyl-chromen-5-yl] tris(fluoranyl)methanesulfonate
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Formula C24H17F3O5S
InChI InChI=1S/C24H17F3O5S/c1-14-8-15(2)10-17(9-14)18-11-21-23(22(12-18)32-33(29,30)24(25,26)27)19(28)13-20(31-21)16-6-4-3-5-7-16/h3-13H,1-2H3
InChIKey LCDCGKGDXDMMDU-UHFFFAOYSA-N
Molecular Weight 474.450 g/mol
SMILES C(S(Oc1c2C(C=C(Oc2cc(c1)-c1cc(C)cc(c1)C)c1ccccc1)=O)(=O)=O)(F)(F)F
SPLASH splash10-00di-0003900000-7b6f4386f129b7045b90
Source of Spectrum U1-2012-1646-7b
Wiley ID 1705578