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3H-pyrazol-3-one, 2-(4-fluorophenyl)-4-[[[(4-fluorophenyl)methyl]amino]methylene]-2,4-dihydro-5-propyl-, (4E)-
SpectraBase Compound ID 2A2i8kSHMC6
InChI InChI=1S/C20H19F2N3O/c1-2-3-19-18(13-23-12-14-4-6-15(21)7-5-14)20(26)25(24-19)17-10-8-16(22)9-11-17/h4-11,13,23H,2-3,12H2,1H3/b18-13+
InChIKey ZVNUSTXOXXMQFG-QGOAFFKASA-N
Mol Weight 355.39 g/mol
Molecular Formula C20H19F2N3O
Exact Mass 355.149619 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID HIhuUDpGies
Name 3H-pyrazol-3-one, 2-(4-fluorophenyl)-4-[[[(4-fluorophenyl)methyl]amino]methylene]-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 355.149618569 u
Formula C20H19F2N3O
InChI InChI=1S/C20H19F2N3O/c1-2-3-19-18(13-23-12-14-4-6-15(21)7-5-14)20(26)25(24-19)17-10-8-16(22)9-11-17/h4-11,13,23H,2-3,12H2,1H3/b18-13+
InChIKey ZVNUSTXOXXMQFG-QGOAFFKASA-N
Molecular Weight 355.389 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_16026
Solvent DMSO-d6
Source Vendor ID: NMR/11250269; Lab Info: PRE; Lab Number: PRE-0104003