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Acetamide, 2-(4-fluorophenoxy)-N-[3-methyl-1-[(3-methylphenyl)methyl]-1H-pyrazol-5-yl]-
SpectraBase Compound ID 5BmIaqDPXzb
InChI InChI=1S/C20H20FN3O2/c1-14-4-3-5-16(10-14)12-24-19(11-15(2)23-24)22-20(25)13-26-18-8-6-17(21)7-9-18/h3-11H,12-13H2,1-2H3,(H,22,25)
InChIKey WRIPBGDDDAZZIG-UHFFFAOYSA-N
Mol Weight 353.4 g/mol
Molecular Formula C20H20FN3O2
Exact Mass 353.153955 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8mVQLAim1EK
Name Acetamide, 2-(4-fluorophenoxy)-N-[3-methyl-1-[(3-methylphenyl)methyl]-1H-pyrazol-5-yl]-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 353.153955057 u
Formula C20H20FN3O2
InChI InChI=1S/C20H20FN3O2/c1-14-4-3-5-16(10-14)12-24-19(11-15(2)23-24)22-20(25)13-26-18-8-6-17(21)7-9-18/h3-11H,12-13H2,1-2H3,(H,22,25)
InChIKey WRIPBGDDDAZZIG-UHFFFAOYSA-N
Molecular Weight 353.397 g/mol
SMILES C(C1=CC(=CC=C1)C)N1C(=CC(=N1)C)NC(COC1=CC=C(C=C1)F)=O