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3-({(Z)-[1-(4-fluorophenyl)-3-methyl-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]methyl}amino)benzoic acid
SpectraBase Compound ID 7zTvnH9J0H8
InChI InChI=1S/C18H14FN3O3/c1-11-16(10-20-14-4-2-3-12(9-14)18(24)25)17(23)22(21-11)15-7-5-13(19)6-8-15/h2-10,20H,1H3,(H,24,25)/b16-10-
InChIKey DXNOKQRWUGTDMH-YBEGLDIGSA-N
Mol Weight 339.33 g/mol
Molecular Formula C18H14FN3O3
Exact Mass 339.101919 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID JBJskREyDUm
Name 3-({(Z)-[1-(4-fluorophenyl)-3-methyl-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]methyl}amino)benzoic acid
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C18H14FN3O3/c1-11-16(10-20-14-4-2-3-12(9-14)18(24)25)17(23)22(21-11)15-7-5-13(19)6-8-15/h2-10,20H,1H3,(H,24,25)/b16-10-
InChIKey DXNOKQRWUGTDMH-YBEGLDIGSA-N
NMR Offset 14.9921
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_16501
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: UZI/8126345; UBI_ID: UBI-016504
Synonyms 3-({[1-(4-fluorophenyl)-3-methyl-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]methyl}amino)benzoic acid
Temperature 313 °C