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(E)-2-Phenyl-3-(phenylsulfonyl)-1,1,1-trifluorobut-2-ene
SpectraBase Compound ID 2l62FYjUwVe
InChI InChI=1S/C16H13F3O2S/c1-12(22(20,21)14-10-6-3-7-11-14)15(16(17,18)19)13-8-4-2-5-9-13/h2-11H,1H3/b15-12+
InChIKey VULHVHXOZBRDNW-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 5zhOPEyUlky
Name (E)-2-Phenyl-3-(phenylsulfonyl)-1,1,1-trifluorobut-2-ene
Alternate Name(s) phenyl (1E)-3,3,3-trifluoro-1-methyl-2-phenyl-1-propenyl sulfone {[(1E)-3,3,3-trifluoro-1-methyl-2-phenyl-1-propenyl]sulfonyl}benzene
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Formula C16H13F3O2S
InChI InChI=1S/C16H13F3O2S/c1-12(22(20,21)14-10-6-3-7-11-14)15(16(17,18)19)13-8-4-2-5-9-13/h2-11H,1H3/b15-12+
InChIKey VULHVHXOZBRDNW-NTCAYCPXSA-N
Molecular Weight 326.333 g/mol
SMILES C(\C(=C/(S(=O)(=O)c1ccccc1)C)c1ccccc1)(F)(F)F
SPLASH splash10-0fvi-0769000000-c0ca89fe67b2d39a40b4
Source of Spectrum SO-0-391-4
Wiley ID 864114