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benzoic acid, 4-[(4Z)-4,5-dihydro-4-[(4-hydroxy-3-methoxyphenyl)methylene]-3-methyl-5-oxo-1H-pyrazol-1-yl]-, 1-methylethyl ester

View entire compound with spectra: 1 NMR

benzoic acid, 4-[(4Z)-4,5-dihydro-4-[(4-hydroxy-3-methoxyphenyl)methylene]-3-methyl-5-oxo-1H-pyrazol-1-yl]-, 1-methylethyl ester
SpectraBase Compound ID DsJeftgSuDk
InChI InChI=1S/C22H22N2O5/c1-13(2)29-22(27)16-6-8-17(9-7-16)24-21(26)18(14(3)23-24)11-15-5-10-19(25)20(12-15)28-4/h5-13,25H,1-4H3/b18-11-
InChIKey WMFYVEQNLVVPDA-WQRHYEAKSA-N
Mol Weight 394.43 g/mol
Molecular Formula C22H22N2O5
Exact Mass 394.152872 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 2wHXbWEhbjh
Name benzoic acid, 4-[(4Z)-4,5-dihydro-4-[(4-hydroxy-3-methoxyphenyl)methylene]-3-methyl-5-oxo-1H-pyrazol-1-yl]-, 1-methylethyl ester
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/C22H22N2O5/c1-13(2)29-22(27)16-6-8-17(9-7-16)24-21(26)18(14(3)23-24)11-15-5-10-19(25)20(12-15)28-4/h5-13,25H,1-4H3/b18-11-
InChIKey WMFYVEQNLVVPDA-WQRHYEAKSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB3_9000_1480
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: NMR/11259693