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1,4-bis(4-Chlorophenyl)-3-(trifluoromethyl)pyrazole
SpectraBase Compound ID 9IHGNP9ki7s
InChI InChI=1S/C16H9Cl2F3N2/c17-11-3-1-10(2-4-11)14-9-23(22-15(14)16(19,20)21)13-7-5-12(18)6-8-13/h1-9H
InChIKey UTFLMSGZVAIJTG-UHFFFAOYSA-N
Mol Weight 357.16 g/mol
Molecular Formula C16H9Cl2F3N2
Exact Mass 356.009488 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 472wv5AKMTN
Name 1,4-bis(4-Chlorophenyl)-3-(trifluoromethyl)pyrazole
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 356.009488187 u
Formula C16H9Cl2F3N2
InChI InChI=1S/C16H9Cl2F3N2/c17-11-3-1-10(2-4-11)14-9-23(22-15(14)16(19,20)21)13-7-5-12(18)6-8-13/h1-9H
InChIKey UTFLMSGZVAIJTG-UHFFFAOYSA-N
Molecular Weight 357.163 g/mol
SMILES C1(=NN(C=2C=CC(=CC2)Cl)C=C1C1=CC=C(C=C1)Cl)C(F)(F)F