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benzoic acid, 4-[(4Z)-4-[(4-butoxy-3-methoxyphenyl)methylene]-4,5-dihydro-3-methyl-5-oxo-1H-pyrazol-1-yl]-, 1-methylethyl ester
SpectraBase Compound ID 3kHTZUgrwmN
InChI InChI=1S/C26H30N2O5/c1-6-7-14-32-23-13-8-19(16-24(23)31-5)15-22-18(4)27-28(25(22)29)21-11-9-20(10-12-21)26(30)33-17(2)3/h8-13,15-17H,6-7,14H2,1-5H3/b22-15-
InChIKey DRXDYDUXVUBVIC-JCMHNJIXSA-N
Mol Weight 450.54 g/mol
Molecular Formula C26H30N2O5
Exact Mass 450.215472 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID B7GjUFMZc3w
Name benzoic acid, 4-[(4Z)-4-[(4-butoxy-3-methoxyphenyl)methylene]-4,5-dihydro-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/C26H30N2O5/c1-6-7-14-32-23-13-8-19(16-24(23)31-5)15-22-18(4)27-28(25(22)29)21-11-9-20(10-12-21)26(30)33-17(2)3/h8-13,15-17H,6-7,14H2,1-5H3/b22-15-
InChIKey DRXDYDUXVUBVIC-JCMHNJIXSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB3_9000_1484
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/11259698