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3-Thiophenecarboxylic acid, 4-hydroxy-5-[[3-hydroxy-4-(methoxycarbonyl)-5-methyl-2-thienyl][2-(trifluoromethyl)phenyl]methyl]-2-methyl-, methyl ester
SpectraBase Compound ID 5zb134WVOY1
InChI InChI=1S/C22H19F3O6S2/c1-9-13(20(28)30-3)16(26)18(32-9)15(11-7-5-6-8-12(11)22(23,24)25)19-17(27)14(10(2)33-19)21(29)31-4/h5-8,15,26-27H,1-4H3
InChIKey HXEMWASJMNQBTO-UHFFFAOYSA-N
Mol Weight 500.5 g/mol
Molecular Formula C22H19F3O6S2
Exact Mass 500.057515 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6keVkgYNBf9
Name 3-Thiophenecarboxylic acid, 4-hydroxy-5-[[3-hydroxy-4-(methoxycarbonyl)-5-methyl-2-thienyl][2-(trifluoromethyl)phenyl]methyl]-2-methyl-, methyl ester
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Formula C22H19F3O6S2
InChI InChI=1S/C22H19F3O6S2/c1-9-13(20(28)30-3)16(26)18(32-9)15(11-7-5-6-8-12(11)22(23,24)25)19-17(27)14(10(2)33-19)21(29)31-4/h5-8,15,26-27H,1-4H3
InChIKey HXEMWASJMNQBTO-UHFFFAOYSA-N
Molecular Weight 500.503 g/mol
SMILES Oc1c(c(sc1C(c1sc(c(c1O)C(=O)OC)C)c1c(C(F)(F)F)cccc1)C)C(=O)OC
SPLASH splash10-0694-8892000000-c2fadc63c8c2dfd92826
Source of Spectrum IY-1-4507-3
Synonyms Dimethyl 5,5'-{[2-(trifluoromethyl)phenyl]methanediyl}bis(4-hydroxy-2-methylthiophene-3-carboxylate) 4-Hydroxy-5-[(3-hydroxy-4-methoxycarbonyl-5-methyl-2-thiophenyl)-[2-(trifluoromethyl)phenyl]methyl]-2-methyl-3-thiophenecarboxylic acid methyl ester Methyl 4-hydroxy-5-[(3-hydroxy-4-methoxycarbonyl-5-methylthiophen-2-yl)-[2-(trifluoromethyl)phenyl]methyl]-2-methylthiophene-3-carboxylate Methyl 4-hydroxy-5-[(3-hydroxy-4-methoxycarbonyl-5-methyl-2-thienyl)-[2-(trifluoromethyl)phenyl]methyl]-2-methyl-thiophene-3-carboxylate Methyl 5-[(4-methoxycarbonyl-5-methyl-3-oxidanyl-thiophen-2-yl)-[2-(trifluoromethyl)phenyl]methyl]-2-methyl-4-oxidanyl-thiophene-3-carboxylate
Wiley ID 1653056