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3-pyridinecarboxamide, N-[1-[(2,3-dihydro-1,5-dimethyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)amino]-2,2,2-trifluoro-1-(trifluoromethyl)ethyl]-
SpectraBase Compound ID AzXpjoOUa7V
InChI InChI=1S/C20H17F6N5O2/c1-12-15(17(33)31(30(12)2)14-8-4-3-5-9-14)28-18(19(21,22)23,20(24,25)26)29-16(32)13-7-6-10-27-11-13/h3-11,28H,1-2H3,(H,29,32)
InChIKey YSKMIAMZZHJJAB-UHFFFAOYSA-N
Mol Weight 473.38 g/mol
Molecular Formula C20H17F6N5O2
Exact Mass 473.128644 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID GkZc51W6n8M
Name 3-pyridinecarboxamide, N-[1-[(2,3-dihydro-1,5-dimethyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)amino]-2,2,2-trifluoro-1-(trifluoromethyl)ethyl]-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 473.128643783 u
Formula C20H17F6N5O2
InChI InChI=1S/C20H17F6N5O2/c1-12-15(17(33)31(30(12)2)14-8-4-3-5-9-14)28-18(19(21,22)23,20(24,25)26)29-16(32)13-7-6-10-27-11-13/h3-11,28H,1-2H3,(H,29,32)
InChIKey YSKMIAMZZHJJAB-UHFFFAOYSA-N
Molecular Weight 473.379 g/mol
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_9786
Solvent DMSO-d6
Source Vendor ID: NMR/10241220; Lab Info: AU; Lab Number: AU-T000967
Temperature 29.85 °C