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(E)-4,4,4-trifluoro-1-(p-tolyl)-2-(p-tolylthio)but-2-en-1-one
SpectraBase Compound ID DgMzV7pQKzx
InChI InChI=1S/C18H15F3OS/c1-12-3-7-14(8-4-12)17(22)16(11-18(19,20)21)23-15-9-5-13(2)6-10-15/h3-11H,1-2H3/b16-11+
InChIKey ZSVUAJFATSYUCY-LFIBNONCSA-N
Mol Weight 336.37 g/mol
Molecular Formula C18H15F3OS
Exact Mass 336.079571 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GYQnThJfEIZ
Name (E)-4,4,4-trifluoro-1-(p-tolyl)-2-(p-tolylthio)but-2-en-1-one
Alternate Name(s) (E)-4,4,4-trifluoro-1-(4-methylphenyl)-2-[(4-methylphenyl)thio]-2-buten-1-one (E)-4,4,4-trifluoro-1-(4-methylphenyl)-2-(4-methylphenyl)sulfanylbut-2-en-1-one (E)-4,4,4-trifluoro-1-(p-tolyl)-2-(p-tolylsulfanyl)but-2-en-1-one
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Formula C18H15F3OS
InChI InChI=1S/C18H15F3OS/c1-12-3-7-14(8-4-12)17(22)16(11-18(19,20)21)23-15-9-5-13(2)6-10-15/h3-11H,1-2H3/b16-11+
InChIKey ZSVUAJFATSYUCY-LFIBNONCSA-N
Molecular Weight 336.372 g/mol
SMILES C(\C=C/(C(c1ccc(cc1)C)=O)Sc1ccc(cc1)C)(F)(F)F
SPLASH splash10-014i-4900000000-11ea7e9d475795476efe
Source of Spectrum F-65-2762-4an
Wiley ID 1681258