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2,2-Difluoro-1-(4-nitrophenyl)ethenyl p-toluenesulfonate
SpectraBase Compound ID 8ycB5sAetrn
InChI InChI=1S/C15H11F2NO5S/c1-10-2-8-13(9-3-10)24(21,22)23-14(15(16)17)11-4-6-12(7-5-11)18(19)20/h2-9H,1H3
InChIKey ROCDZXCCRBIZCA-UHFFFAOYSA-N
Mol Weight 355.31 g/mol
Molecular Formula C15H11F2NO5S
Exact Mass 355.0326 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JaPImhC1NyW
Name 2,2-Difluoro-1-(4-nitrophenyl)ethenyl p-toluenesulfonate
Alternate Name(s) 2,2-Difluoro-1-(4-nitrophenyl)vinyl 4-methylbenzenesulfonate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H11F2NO5S
InChI InChI=1S/C15H11F2NO5S/c1-10-2-8-13(9-3-10)24(21,22)23-14(15(16)17)11-4-6-12(7-5-11)18(19)20/h2-9H,1H3
InChIKey ROCDZXCCRBIZCA-UHFFFAOYSA-N
Literature Reference DOI 10.1021/ol1024037
Molecular Weight 355.312 g/mol
SMILES C(OS(=O)(c1ccc(cc1)C)=O)(=C(F)F)c1ccc(cc1)[N+](=O)[O-]
SPLASH splash10-0006-9400000000-7edc4e559ee22d8d8d5f
Source of Spectrum A1-12-5518/SMS5-3g
Wiley ID 1752710