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

View entire compound with spectra: 2 NMR

2-[5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]-N-(3-quinolinyl)acetamide
SpectraBase Compound ID 6QMsIIhsQd4
InChI InChI=1S/C16H13F3N4O/c1-10-6-14(16(17,18)19)22-23(10)9-15(24)21-12-7-11-4-2-3-5-13(11)20-8-12/h2-8H,9H2,1H3,(H,21,24)
InChIKey MIWQSYMMBRQQHX-UHFFFAOYSA-N
Mol Weight 334.3 g/mol
Molecular Formula C16H13F3N4O
Exact Mass 334.104146 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Llx6wNmI9wP
Name 2-[5-Methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]-N-(3-quinolinyl)acetamide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 334.104145543 u
Formula C16H13F3N4O
InChI InChI=1S/C16H13F3N4O/c1-10-6-14(16(17,18)19)22-23(10)9-15(24)21-12-7-11-4-2-3-5-13(11)20-8-12/h2-8H,9H2,1H3,(H,21,24)
InChIKey MIWQSYMMBRQQHX-UHFFFAOYSA-N
Molecular Weight 334.302 g/mol
SMILES N(C(CN1N=C(C=C1C)C(F)(F)F)=O)C1=CC2=CC=CC=C2N=C1