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(5,6,8-trimethoxy-7-methyl-4-phenyl-2-quinolyl) trifluoromethanesulfonate
SpectraBase Compound ID La0q4qLvq1F
InChI InChI=1S/C20H18F3NO6S/c1-11-17(27-2)16-15(19(29-4)18(11)28-3)13(12-8-6-5-7-9-12)10-14(24-16)30-31(25,26)20(21,22)23/h5-10H,1-4H3
InChIKey DUSOBDHHDBLNPA-UHFFFAOYSA-N
Mol Weight 457.42 g/mol
Molecular Formula C20H18F3NO6S
Exact Mass 457.080693 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6GBvxps9jfs
Name (5,6,8-trimethoxy-7-methyl-4-phenyl-2-quinolyl) trifluoromethanesulfonate
Alternate Name(s) (5,6,8-trimethoxy-7-methyl-4-phenyl-quinolin-2-yl) tris(fluoranyl)methanesulfonate (5,6,8-trimethoxy-7-methyl-4-phenylquinolin-2-yl) trifluoromethanesulfonate Trifluoromethanesulfonic acid (5,6,8-trimethoxy-7-methyl-4-phenyl-2-quinolinyl) ester Trifluoromethanesulfonic acid (5,6,8-trimethoxy-7-methyl-4-phenyl-2-quinolyl) ester
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Formula C20H18F3NO6S
InChI InChI=1S/C20H18F3NO6S/c1-11-17(27-2)16-15(19(29-4)18(11)28-3)13(12-8-6-5-7-9-12)10-14(24-16)30-31(25,26)20(21,22)23/h5-10H,1-4H3
InChIKey DUSOBDHHDBLNPA-UHFFFAOYSA-N
Molecular Weight 457.420 g/mol
SMILES c1(nc2c(c(c(c(c2c(c1)-c1ccccc1)OC)OC)C)OC)OS(=O)(=O)C(F)(F)F
SPLASH splash10-0a4i-0002900000-c32f0b277845ab2c2ef9
Source of Spectrum E1-45-1697-4
Wiley ID 1554138