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3H-pyrazol-3-one, 2-(4-fluorophenyl)-4-[[(2-furanylmethyl)amino]methylene]-2,4-dihydro-5-propyl-, (4E)-
SpectraBase Compound ID BwqYyfdYegN
InChI InChI=1S/C18H18FN3O2/c1-2-4-17-16(12-20-11-15-5-3-10-24-15)18(23)22(21-17)14-8-6-13(19)7-9-14/h3,5-10,12,20H,2,4,11H2,1H3/b16-12+
InChIKey HTYRBWMXTDBVAK-FOWTUZBSSA-N
Mol Weight 327.36 g/mol
Molecular Formula C18H18FN3O2
Exact Mass 327.138305 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 8HA4oCflnqR
Name 3H-pyrazol-3-one, 2-(4-fluorophenyl)-4-[[(2-furanylmethyl)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 327.138304993 u
Formula C18H18FN3O2
InChI InChI=1S/C18H18FN3O2/c1-2-4-17-16(12-20-11-15-5-3-10-24-15)18(23)22(21-17)14-8-6-13(19)7-9-14/h3,5-10,12,20H,2,4,11H2,1H3/b16-12+
InChIKey HTYRBWMXTDBVAK-FOWTUZBSSA-N
Molecular Weight 327.359 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_14720
Solvent DMSO-d6
Source Vendor ID: NMR/11220363; Lab Info: PRE; Lab Number: PRE-s000051