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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
Mol Weight 426.39 g/mol
Molecular Formula C19H14F4N2O3S
Exact Mass 426.066126 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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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
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
Synonyms 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
Wiley ID 1555191