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(E)-2-(4-Bromophenyl)-3-(phenylsulfonyl)-1,1,1-trifluorobut-2-ene
SpectraBase Compound ID 8UpvcrhzAP8
InChI InChI=1S/C16H12BrF3O2S/c1-11(23(21,22)14-5-3-2-4-6-14)15(16(18,19)20)12-7-9-13(17)10-8-12/h2-10H,1H3/b15-11+
InChIKey HOZPBLHUBQNFQO-RVDMUPIBSA-N
Mol Weight 405.23 g/mol
Molecular Formula C16H12BrF3O2S
Exact Mass 403.969348 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 75qI4rtrOLr
Name (E)-2-(4-Bromophenyl)-3-(phenylsulfonyl)-1,1,1-trifluorobut-2-ene
Alternate Name(s) (1E)-2-(4-bromophenyl)-3,3,3-trifluoro-1-methyl-1-propenyl phenyl sulfone 1-Bromo-4-[(1E)-2-(phenylsulfonyl)-1-(trifluoromethyl)-1-propenyl]benzene
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Formula C16H12BrF3O2S
InChI InChI=1S/C16H12BrF3O2S/c1-11(23(21,22)14-5-3-2-4-6-14)15(16(18,19)20)12-7-9-13(17)10-8-12/h2-10H,1H3/b15-11+
InChIKey HOZPBLHUBQNFQO-RVDMUPIBSA-N
Molecular Weight 405.229 g/mol
SMILES C(\C(=C/(S(=O)(=O)c1ccccc1)C)c1ccc(cc1)Br)(F)(F)F
SPLASH splash10-0udi-0090400000-66c8cc3ef1edca4b05d8
Source of Spectrum SO-0-390-4
Wiley ID 864120