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(E)-1,1-difluoro-4-phenylbuta-1,3-dien-2-yl 4-methylbenzenesulfonate
SpectraBase Compound ID 24fFhZGvM6W
InChI InChI=1S/C17H14F2O3S/c1-13-7-10-15(11-8-13)23(20,21)22-16(17(18)19)12-9-14-5-3-2-4-6-14/h2-12H,1H3/b12-9+
InChIKey HHJVONHWCOTEGW-FMIVXFBMSA-N
Mol Weight 336.35 g/mol
Molecular Formula C17H14F2O3S
Exact Mass 336.063172 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1WgsVl7fEs2
Name (E)-1,1-difluoro-4-phenylbuta-1,3-dien-2-yl 4-methylbenzenesulfonate
Appearance Colorless oil
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Formula C17H14F2O3S
InChI InChI=1S/C17H14F2O3S/c1-13-7-10-15(11-8-13)23(20,21)22-16(17(18)19)12-9-14-5-3-2-4-6-14/h2-12H,1H3/b12-9+
InChIKey HHJVONHWCOTEGW-FMIVXFBMSA-N
Instrument Name Agilent Technologies G1530N
Ionization Type EI
Literature Reference DOI 10.3762/bjoc.9.286
Molecular Weight 336.353 g/mol
SMILES C(F)(=C(\C=C\c1ccccc1)OS(c1ccc(cc1)C)(=O)=O)F
SPLASH splash10-001l-5900000000-27c20223a5de81449764
Source of Spectrum BJO-9-SM7-5a
Wiley ID 1853806