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N-(2,4-dichlorobenzyl)-2-[5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]acetamide

View entire compound with spectra: 2 NMR

N-(2,4-dichlorobenzyl)-2-[5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]acetamide
SpectraBase Compound ID In9lHFeLdw5
InChI InChI=1S/C14H12Cl2F3N3O/c1-8-4-12(14(17,18)19)21-22(8)7-13(23)20-6-9-2-3-10(15)5-11(9)16/h2-5H,6-7H2,1H3,(H,20,23)
InChIKey LKKATRXTWJDRTG-UHFFFAOYSA-N
Mol Weight 366.17 g/mol
Molecular Formula C14H12Cl2F3N3O
Exact Mass 365.030952 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GkshADZZ83d
Name N-(2,4-Dichlorobenzyl)-2-[5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]acetamide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 365.030951906 u
Formula C14H12Cl2F3N3O
InChI InChI=1S/C14H12Cl2F3N3O/c1-8-4-12(14(17,18)19)21-22(8)7-13(23)20-6-9-2-3-10(15)5-11(9)16/h2-5H,6-7H2,1H3,(H,20,23)
InChIKey LKKATRXTWJDRTG-UHFFFAOYSA-N
Molecular Weight 366.171 g/mol
SMILES N(CC1=C(C=C(C=C1)Cl)Cl)C(CN1N=C(C=C1C)C(F)(F)F)=O