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3-Difluoromethyl-1-methyl-1H-pyrazol-4-carbonyl-(3',4'-dichloro-5-fluorobiphenyl-2-yl)-amide
SpectraBase Compound ID KXM1OjqJSE8
InChI InChI=1S/C18H12Cl2F3N3O/c1-26-8-12(16(25-26)17(22)23)18(27)24-15-5-3-10(21)7-11(15)9-2-4-13(19)14(20)6-9/h2-8,17H,1H3,(H,24,27)
InChIKey LDLMOOXUCMHBMZ-UHFFFAOYSA-N
Mol Weight 414.22 g/mol
Molecular Formula C18H12Cl2F3N3O
Exact Mass 413.030952 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CBtuxTYT3dG
Name 3-Difluoromethyl-1-methyl-1H-pyrazol-4-carbonyl-(3',4'-dichloro-5-fluorobiphenyl-2-yl)-amide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H12Cl2F3N3O
InChI InChI=1S/C18H12Cl2F3N3O/c1-26-8-12(16(25-26)17(22)23)18(27)24-15-5-3-10(21)7-11(15)9-2-4-13(19)14(20)6-9/h2-8,17H,1H3,(H,24,27)
InChIKey LDLMOOXUCMHBMZ-UHFFFAOYSA-N
Instrument Name Jeol GC mate II
Ionization Type EI
Molecular Weight 414.215 g/mol
Reported Formula C18H12Cl2F3N3O
SMILES N(c1ccc(cc1-c1ccc(Cl)c(Cl)c1)F)C(=O)c1c(C(F)F)n[n](C)c1
SPLASH splash10-0bt9-1900500000-912cf6a6d7ac6ccf88bb
Source of Spectrum WO2012120003A1
Thin-Layer Chromatography Rf = 0.1 (Hexane/EtOAc, 3:2)
Wiley ID 1845524