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5-Trifluoromethyl-3-phenyl-1H-1-(phenoxyacetyl)pyrazole
SpectraBase Compound ID 85U7I0rrYnS
InChI InChI=1S/C18H13F3N2O2/c19-18(20,21)16-11-15(13-7-3-1-4-8-13)22-23(16)17(24)12-25-14-9-5-2-6-10-14/h1-11H,12H2
InChIKey KTPUZZSLSVGSGH-UHFFFAOYSA-N
Mol Weight 346.31 g/mol
Molecular Formula C18H13F3N2O2
Exact Mass 346.092912 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4g5hhYdPz1q
Name 5-Trifluoromethyl-3-phenyl-1H-1-(phenoxyacetyl)pyrazole
Appearance Yellow solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H13F3N2O2
InChI InChI=1S/C18H13F3N2O2/c19-18(20,21)16-11-15(13-7-3-1-4-8-13)22-23(16)17(24)12-25-14-9-5-2-6-10-14/h1-11H,12H2
InChIKey KTPUZZSLSVGSGH-UHFFFAOYSA-N
Instrument Name GCMS
Ionization Type EI
Literature Reference DOI 10.3998/ark.5550190.0013.806
Molecular Weight 346.309 g/mol
SMILES c1([n](nc(c1)-c1ccccc1)C(COc1ccccc1)=O)C(F)(F)F
SPLASH splash10-004i-3093000000-0a1e32cc3ab8ed9ca1b3
Source of Spectrum ARK-2012-74-4bc
Wiley ID 1864733