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(3Z,5E)-1,1,1-Trifluoro-6-phenyl-3-(tosyloxy)hexa-3,5-dien-2-one
SpectraBase Compound ID 36sLq3mX9et
InChI InChI=1S/C19H15F3O4S/c1-14-10-12-16(13-11-14)27(24,25)26-17(18(23)19(20,21)22)9-5-8-15-6-3-2-4-7-15/h2-13H,1H3/b8-5+,17-9-
InChIKey FEUHFZIMHMXHQD-WIXUPIFPSA-N
Mol Weight 396.38 g/mol
Molecular Formula C19H15F3O4S
Exact Mass 396.064315 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FJFyURbG137
Name (3Z,5E)-1,1,1-Trifluoro-6-phenyl-3-(tosyloxy)hexa-3,5-dien-2-one
Comments Less than 3 mono-isotopic peaks
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Formula C19H15F3O4S
InChI InChI=1S/C19H15F3O4S/c1-14-10-12-16(13-11-14)27(24,25)26-17(18(23)19(20,21)22)9-5-8-15-6-3-2-4-7-15/h2-13H,1H3/b8-5+,17-9-
InChIKey FEUHFZIMHMXHQD-WIXUPIFPSA-N
Molecular Weight 396.380 g/mol
SMILES C(\C(OS(c1ccc(cc1)C)(=O)=O)=C\C=C\c1ccccc1)(C(F)(F)F)=O
SPLASH splash10-0006-0092000000-38d0f39172ca990bf74b
Source of Spectrum KC-0-2422-7
Synonyms (1Z,3E)-4-phenyl-1-(trifluoroacetyl)-1,3-butadienyl 4-methylbenzenesulfonate (3Z,5E)-1,1,1-Trifluoro-6-phenyl-3-(toyloxy)hexa-3,5-dien-2-one 4-methylbenzenesulfonic acid[(1Z,3E)-4-phenyl-1-(2,2,2-trifluoroacetyl)buta-1,3-dienyl]ester 4-methylbenzenesulfonic acid[(3Z,5E)-1,1,1-trifluoro-2-oxo-6-phenylhexa-3,5-dien-3-yl]ester [(1Z,3E)-4-phenyl-1-(2,2,2-trifluoroacetyl)buta-1,3-dienyl]4-methylbenzenesulfonate [(3Z,5E)-1,1,1-trifluoro-2-oxo-6-phenylhexa-3,5-dien-3-yl]4-methylbenzenesulfonate [(3Z,5E)-1,1,1-tris(fluoranyl)-2-oxidanylidene-6-phenyl-hexa-3,5-dien-3-yl]4-methylbenzenesulfonate 4-methylbenzenesulfonic acid [(3Z,5E)-1,1,1-trifluoro-2-oxo-6-phenylhexa-3,5-dien-3-yl] ester [(3Z,5E)-1,1,1-trifluoro-2-oxo-6-phenylhexa-3,5-dien-3-yl] 4-methylbenzenesulfonate [(1Z,3E)-4-phenyl-1-(2,2,2-trifluoroacetyl)buta-1,3-dienyl] 4-methylbenzenesulfonate [(3Z,5E)-1,1,1-tris(fluoranyl)-2-oxidanylidene-6-phenyl-hexa-3,5-dien-3-yl] 4-methylbenzenesulfonate
Wiley ID 826009