2,2-Difluoroa-1-(2,4-difluorophenyl)-2-[3,5-dimethyl-1-(phenylsulfonyl)-4-pyrazolyl]ethanone

SpectraBase Compound ID	EdlDLdkp791
InChI	InChI=1S/C19H14F4N2O3S/c1-11-17(19(22,23)18(26)15-9-8-13(20)10-16(15)21)12(2)25(24-11)29(27,28)14-6-4-3-5-7-14/h3-10H,1-2H3
InChIKey	JQBAIKZIAATRKC-UHFFFAOYSA-N Google Search
Mol Weight	426.39 g/mol
Molecular Formula	C19H14F4N2O3S
Exact Mass	426.066126 g/mol

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SpectraBase Spectrum ID	CUjiwlw1OCg
Name	2,2-Difluoroa-1-(2,4-difluorophenyl)-2-[3,5-dimethyl-1-(phenylsulfonyl)-4-pyrazolyl]ethanone
Alternate Name(s)	2-[1-(benzenesulfonyl)-3,5-dimethyl-4-pyrazolyl]-1-(2,4-difluorophenyl)-2,2-difluoroethanone 2-[1-(benzenesulfonyl)-3,5-dimethylpyrazol-4-yl]-1-(2,4-difluorophenyl)-2,2-difluoroethanone 2-[1-(benzenesulfonyl)-3,5-dimethyl-pyrazol-4-yl]-1-(2,4-difluorophenyl)-2,2-difluoro-ethanone 1-[2,4-bis(fluoranyl)phenyl]-2-[3,5-dimethyl-1-(phenylsulfonyl)pyrazol-4-yl]-2,2-bis(fluoranyl)ethanone
Comments	Less than 3 mono-isotopic peaks
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C19H14F4N2O3S
InChI	InChI=1S/C19H14F4N2O3S/c1-11-17(19(22,23)18(26)15-9-8-13(20)10-16(15)21)12(2)25(24-11)29(27,28)14-6-4-3-5-7-14/h3-10H,1-2H3
InChIKey	JQBAIKZIAATRKC-UHFFFAOYSA-N
Molecular Weight	426.386 g/mol
SMILES	c1(S([n]2c(c(C(C(c3c(cc(cc3)F)F)=O)(F)F)c(n2)C)C)(=O)=O)ccccc1
SPLASH	splash10-000i-0490000000-d3eb7ae1c73bc6d338c1
Source of Spectrum	E2-48-986-2
Wiley ID	1555191