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3-Benzylsulfanyl-3-fluoro-2-trifluoromethyl-acrylic acid methyl ester
SpectraBase Compound ID G1wQ7R8jHgq
InChI InChI=1S/C12H10F4O2S/c1-18-11(17)9(12(14,15)16)10(13)19-7-8-5-3-2-4-6-8/h2-6H,7H2,1H3/b10-9-
InChIKey PBTCHYXWTMZPQU-KTKRTIGZSA-N
Mol Weight 294.26 g/mol
Molecular Formula C12H10F4O2S
Exact Mass 294.033763 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6dT1eQfD30a
Name 3-Benzylsulfanyl-3-fluoro-2-trifluoromethyl-acrylic acid methyl ester
Alternate Name(s) (Z)-3-(benzylthio)-3-fluoro-2-(trifluoromethyl)acrylic acid methyl ester (Z)-3-fluoro-3-(phenylmethylthio)-2-(trifluoromethyl)-2-propenoic acid methyl ester Methyl (2Z)-3-(benzylsulfanyl)-3-fluoro-2-(trifluoromethyl)-2-propenoate Methyl (Z)-3-benzylsulfanyl-3-fluoro-2-(trifluoromethyl)prop-2-enoate Methyl (Z)-3-fluoranyl-3-(phenylmethylsulfanyl)-2-(trifluoromethyl)prop-2-enoate
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Formula C12H10F4O2S
InChI InChI=1S/C12H10F4O2S/c1-18-11(17)9(12(14,15)16)10(13)19-7-8-5-3-2-4-6-8/h2-6H,7H2,1H3/b10-9-
InChIKey PBTCHYXWTMZPQU-KTKRTIGZSA-N
Molecular Weight 294.264 g/mol
SMILES C(S\C(F)=C/(C(=O)OC)C(F)(F)F)c1ccccc1
SPLASH splash10-0006-9000000000-b8083caae852109c0bf9
Wiley ID 1463064