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3-Fluoro-3-(4-hydroxy-2-methyl-phenylsulfanyl)-2-trifluoromethyl-acrylic acid methyl ester
SpectraBase Compound ID E9aPM0mYUN0
InChI InChI=1S/C12H10F4O3S/c1-6-5-7(17)3-4-8(6)20-10(13)9(11(18)19-2)12(14,15)16/h3-5,17H,1-2H3/b10-9+
InChIKey HJQYAKAIBONHDT-MDZDMXLPSA-N
Mol Weight 310.26 g/mol
Molecular Formula C12H10F4O3S
Exact Mass 310.028678 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JHgaCwbNgB1
Name 3-Fluoro-3-(4-hydroxy-2-methyl-phenylsulfanyl)-2-trifluoromethyl-acrylic acid methyl ester
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Formula C12H10F4O3S
InChI InChI=1S/C12H10F4O3S/c1-6-5-7(17)3-4-8(6)20-10(13)9(11(18)19-2)12(14,15)16/h3-5,17H,1-2H3/b10-9+
InChIKey HJQYAKAIBONHDT-MDZDMXLPSA-N
Molecular Weight 310.263 g/mol
SMILES Oc1ccc(S\C(=C\(C(F)(F)F)C(=O)OC)F)c(c1)C
SPLASH splash10-0bvi-9641000000-addd745b2771396f92ac
Synonyms (E)-3-fluoro-3-[(4-hydroxy-2-methyl-phenyl)thio]-2-(trifluoromethyl)acrylic acid methyl ester (E)-3-fluoro-3-[(4-hydroxy-2-methylphenyl)thio]-2-(trifluoromethyl)-2-propenoic acid methyl ester Methyl (2E)-3-fluoro-3-[(4-hydroxy-2-methylphenyl)sulfanyl]-2-(trifluoromethyl)-2-propenoate Methyl (E)-3-fluoranyl-3-(2-methyl-4-oxidanyl-phenyl)sulfanyl-2-(trifluoromethyl)prop-2-enoate Methyl (E)-3-fluoro-3-(4-hydroxy-2-methyl-phenyl)sulfanyl-2-(trifluoromethyl)prop-2-enoate
Wiley ID 1463124