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Methyl 3,3-bis(benzylsulfanyl)-2-(trifluoromethyl)acrylate
SpectraBase Compound ID 1D353gOtxNl
InChI InChI=1S/C19H17F3O2S2/c1-24-17(23)16(19(20,21)22)18(25-12-14-8-4-2-5-9-14)26-13-15-10-6-3-7-11-15/h2-11H,12-13H2,1H3
InChIKey MOLBNGJCHHAYSD-UHFFFAOYSA-N
Mol Weight 398.46 g/mol
Molecular Formula C19H17F3O2S2
Exact Mass 398.062207 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2iilr41dV00
Name Methyl 3,3-bis(benzylsulfanyl)-2-(trifluoromethyl)acrylate
Alternate Name(s) 3,3-bis(benzylthio)-2-(trifluoromethyl)acrylic acid methyl ester 3,3-bis(phenylmethylthio)-2-(trifluoromethyl)-2-propenoic acid methyl ester 3,3-Bis-benzylsulfanyl-2-trifluoromethyl-acrylic acid methyl ester Methyl 3,3-bis(benzylsulfanyl)-2-(trifluoromethyl)prop-2-enoate Methyl 3,3-bis(phenylmethylsulfanyl)-2-(trifluoromethyl)prop-2-enoate
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Formula C19H17F3O2S2
InChI InChI=1S/C19H17F3O2S2/c1-24-17(23)16(19(20,21)22)18(25-12-14-8-4-2-5-9-14)26-13-15-10-6-3-7-11-15/h2-11H,12-13H2,1H3
InChIKey MOLBNGJCHHAYSD-UHFFFAOYSA-N
Molecular Weight 398.458 g/mol
SMILES c1ccccc1CSC(SCc1ccccc1)=C(C(=O)OC)C(F)(F)F
SPLASH splash10-0006-9200000000-ab2cca2db726e3ccf42a
Wiley ID 1463066