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4-{(4Z)-4-[2-(benzyloxy)-3-methoxybenzylidene]-3-methyl-5-oxo-4,5-dihydro-1H-pyrazol-1-yl}benzoic acid
SpectraBase Compound ID 2eIGCwuPn9G
InChI InChI=1S/C26H22N2O5/c1-17-22(25(29)28(27-17)21-13-11-19(12-14-21)26(30)31)15-20-9-6-10-23(32-2)24(20)33-16-18-7-4-3-5-8-18/h3-15H,16H2,1-2H3,(H,30,31)/b22-15-
InChIKey ARFRUENRCVAUGT-JCMHNJIXSA-N
Mol Weight 442.47 g/mol
Molecular Formula C26H22N2O5
Exact Mass 442.152872 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 9HQuiqtfDIU
Name 4-{(4Z)-4-[2-(benzyloxy)-3-methoxybenzylidene]-3-methyl-5-oxo-4,5-dihydro-1H-pyrazol-1-yl}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/C26H22N2O5/c1-17-22(25(29)28(27-17)21-13-11-19(12-14-21)26(30)31)15-20-9-6-10-23(32-2)24(20)33-16-18-7-4-3-5-8-18/h3-15H,16H2,1-2H3,(H,30,31)/b22-15-
InChIKey ARFRUENRCVAUGT-JCMHNJIXSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_13946
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/9054918; UBI_ID: UBI-013949
Synonyms 4-{4-[2-(benzyloxy)-3-methoxybenzylidene]-3-methyl-5-oxo-4,5-dihydro-1H-pyrazol-1-yl}benzoic acid
Temperature 308 °C