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2,2-Difluoro-1-(3-tolyl)ethenyl p-toluenesulfonate
SpectraBase Compound ID 92qj1oWsmQ
InChI InChI=1S/C16H14F2O3S/c1-11-6-8-14(9-7-11)22(19,20)21-15(16(17)18)13-5-3-4-12(2)10-13/h3-10H,1-2H3
InChIKey PIJUDUAUOBRSOF-UHFFFAOYSA-N
Mol Weight 324.34 g/mol
Molecular Formula C16H14F2O3S
Exact Mass 324.063172 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6P1BRETYiZ9
Name 2,2-Difluoro-1-(3-tolyl)ethenyl p-toluenesulfonate
Alternate Name(s) 2,2-Difluoro-1-(m-tolyl)vinyl 4-methylbenzenesulfonate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H14F2O3S
InChI InChI=1S/C16H14F2O3S/c1-11-6-8-14(9-7-11)22(19,20)21-15(16(17)18)13-5-3-4-12(2)10-13/h3-10H,1-2H3
InChIKey PIJUDUAUOBRSOF-UHFFFAOYSA-N
Literature Reference DOI 10.1021/ol1024037
Molecular Weight 324.342 g/mol
SMILES C(OS(=O)(c1ccc(cc1)C)=O)(=C(F)F)c1cc(ccc1)C
SPLASH splash10-00kf-9500000000-291fbd0dc5d114a666b0
Source of Spectrum A1-12-5518/SMS7-3l
Wiley ID 1752715