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1-(4'-Fluorobiphenyl-4-yloxy)-3,3-dimethyl-1-(1H-1,2,4-triazol-1-yl)butan-2-one
SpectraBase Compound ID 1FIEkzkmkgK
InChI InChI=1S/C20H20FN3O2/c1-20(2,3)18(25)19(24-13-22-12-23-24)26-17-10-6-15(7-11-17)14-4-8-16(21)9-5-14/h4-13,19H,1-3H3
InChIKey CZBRBPUATBRXFD-UHFFFAOYSA-N
Mol Weight 353.4 g/mol
Molecular Formula C20H20FN3O2
Exact Mass 353.153955 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9GsTvH2DfEg
Name 1-(4'-Fluorobiphenyl-4-yloxy)-3,3-dimethyl-1-(1H-1,2,4-triazol-1-yl)butan-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H20FN3O2
InChI InChI=1S/C20H20FN3O2/c1-20(2,3)18(25)19(24-13-22-12-23-24)26-17-10-6-15(7-11-17)14-4-8-16(21)9-5-14/h4-13,19H,1-3H3
InChIKey CZBRBPUATBRXFD-UHFFFAOYSA-N
Molecular Weight 353.397 g/mol
SMILES C([n]1ncnc1)(C(C(C)(C)C)=O)Oc1ccc(-c2ccc(cc2)F)cc1
SPLASH splash10-001i-5690000000-b10c5aa46ee6cef3e341
Source of Spectrum F-70-284-10
Synonyms 1-((4'-fluoro-[1,1'-biphenyl]-4-yl)oxy)-3,3-dimethyl-1-(1H-1,2,4-triazol-1-yl)butan-2-one
Wiley ID 1742465