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1,1,1-Trifluoro-3-phenyl-2-phenylsulfonyl-2-butene
SpectraBase Compound ID FEIypRs49vC
InChI InChI=1S/C16H13F3O2S/c1-12(13-8-4-2-5-9-13)15(16(17,18)19)22(20,21)14-10-6-3-7-11-14/h2-11H,1H3/b15-12+
InChIKey ORYHFOHIZPMOGB-NTCAYCPXSA-N
Mol Weight 326.33 g/mol
Molecular Formula C16H13F3O2S
Exact Mass 326.058835 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3yW61DdCWjH
Name 1,1,1-Trifluoro-3-phenyl-2-phenylsulfonyl-2-butene
Alternate Name(s) phenyl (1E)-2-phenyl-1-(trifluoromethyl)-1-propenyl sulfone {[(1E)-2-phenyl-1-(trifluoromethyl)-1-propenyl]sulfonyl}benzene
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Formula C16H13F3O2S
InChI InChI=1S/C16H13F3O2S/c1-12(13-8-4-2-5-9-13)15(16(17,18)19)22(20,21)14-10-6-3-7-11-14/h2-11H,1H3/b15-12+
InChIKey ORYHFOHIZPMOGB-NTCAYCPXSA-N
Molecular Weight 326.333 g/mol
SMILES c1(S(\C(C(F)(F)F)=C/(c2ccccc2)C)(=O)=O)ccccc1
SPLASH splash10-0wmi-4930000000-b52c9af14d499615947b
Source of Spectrum QB-22-354-3
Wiley ID 860667