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3H-pyrazol-3-one, 2-(4-fluorophenyl)-2,4-dihydro-5-propyl-4-[(propylamino)methylene]-, (4E)-
SpectraBase Compound ID 5RLE5GJpDg5
InChI InChI=1S/C16H20FN3O/c1-3-5-15-14(11-18-10-4-2)16(21)20(19-15)13-8-6-12(17)7-9-13/h6-9,11,18H,3-5,10H2,1-2H3/b14-11+
InChIKey FXQXIIXYYZAHIH-SDNWHVSQSA-N
Mol Weight 289.35 g/mol
Molecular Formula C16H20FN3O
Exact Mass 289.15904 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 78RmliAU0nQ
Name 3H-pyrazol-3-one, 2-(4-fluorophenyl)-2,4-dihydro-5-propyl-4-[(propylamino)methylene]-, (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 289.159040438 u
Formula C16H20FN3O
InChI InChI=1S/C16H20FN3O/c1-3-5-15-14(11-18-10-4-2)16(21)20(19-15)13-8-6-12(17)7-9-13/h6-9,11,18H,3-5,10H2,1-2H3/b14-11+
InChIKey FXQXIIXYYZAHIH-SDNWHVSQSA-N
Molecular Weight 289.354 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_14715
Solvent DMSO-d6
Source Vendor ID: NMR/11220352; Lab Info: PRE; Lab Number: PRE-s000040