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3H-pyrazol-3-one, 4-[[[(2-chlorophenyl)methyl]amino]methylene]-2-(4-fluorophenyl)-2,4-dihydro-5-propyl-, (4E)-
SpectraBase Compound ID JtMcptf6lP1
InChI InChI=1S/C20H19ClFN3O/c1-2-5-19-17(13-23-12-14-6-3-4-7-18(14)21)20(26)25(24-19)16-10-8-15(22)9-11-16/h3-4,6-11,13,23H,2,5,12H2,1H3/b17-13+
InChIKey HYIPAPFZLFYQLP-GHRIWEEISA-N
Mol Weight 371.84 g/mol
Molecular Formula C20H19ClFN3O
Exact Mass 371.120068 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 9hYasf3Q5Ax
Name 3H-pyrazol-3-one, 4-[[[(2-chlorophenyl)methyl]amino]methylene]-2-(4-fluorophenyl)-2,4-dihydro-5-propyl-, (4E)-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 371.120068106 u
Formula C20H19ClFN3O
InChI InChI=1S/C20H19ClFN3O/c1-2-5-19-17(13-23-12-14-6-3-4-7-18(14)21)20(26)25(24-19)16-10-8-15(22)9-11-16/h3-4,6-11,13,23H,2,5,12H2,1H3/b17-13+
InChIKey HYIPAPFZLFYQLP-GHRIWEEISA-N
Molecular Weight 371.843 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_15951
Solvent DMSO-d6
Source Vendor ID: NMR/11230059; Lab Info: PRE; Lab Number: PRE-s000135