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7-(4-Fluorophenyl)-4-oxo-2-phenyl-4H-chromen-5-yl Trifluoromethanesulfonate
SpectraBase Compound ID 7bEcDj44YF7
InChI InChI=1S/C22H12F4O5S/c23-16-8-6-13(7-9-16)15-10-19-21(20(11-15)31-32(28,29)22(24,25)26)17(27)12-18(30-19)14-4-2-1-3-5-14/h1-12H
InChIKey WVFMIZCCRRPOAF-UHFFFAOYSA-N
Mol Weight 464.39 g/mol
Molecular Formula C22H12F4O5S
Exact Mass 464.034157 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 15ZeEZUu73j
Name 7-(4-Fluorophenyl)-4-oxo-2-phenyl-4H-chromen-5-yl Trifluoromethanesulfonate
Alternate Name(s) Trifluoromethanesulfonic acid [7-(4-fluorophenyl)-4-oxo-2-phenyl-1-benzopyran-5-yl] ester [7-(4-fluorophenyl)-4-oxo-2-phenylchromen-5-yl] trifluoromethanesulfonate [7-(4-fluorophenyl)-4-oxo-2-phenyl-chromen-5-yl] trifluoromethanesulfonate [7-(4-fluorophenyl)-4-oxidanylidene-2-phenyl-chromen-5-yl] tris(fluoranyl)methanesulfonate
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Formula C22H12F4O5S
InChI InChI=1S/C22H12F4O5S/c23-16-8-6-13(7-9-16)15-10-19-21(20(11-15)31-32(28,29)22(24,25)26)17(27)12-18(30-19)14-4-2-1-3-5-14/h1-12H
InChIKey WVFMIZCCRRPOAF-UHFFFAOYSA-N
Molecular Weight 464.387 g/mol
SMILES C(S(Oc1c2C(C=C(Oc2cc(c1)-c1ccc(cc1)F)c1ccccc1)=O)(=O)=O)(F)(F)F
SPLASH splash10-03di-0004900000-295c48a791bd6691290f
Source of Spectrum U1-2012-1649-7f
Wiley ID 1705574