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benzoic acid, 4-[(4Z)-4,5-dihydro-4-[(3-methoxy-4-propoxyphenyl)methylene]-3-methyl-5-oxo-1H-pyrazol-1-yl]-, 1-methylethyl ester
SpectraBase Compound ID CAtthpINbQI
InChI InChI=1S/C25H28N2O5/c1-6-13-31-22-12-7-18(15-23(22)30-5)14-21-17(4)26-27(24(21)28)20-10-8-19(9-11-20)25(29)32-16(2)3/h7-12,14-16H,6,13H2,1-5H3/b21-14-
InChIKey QDWDFJBXKYGMSE-STZFKDTASA-N
Mol Weight 436.51 g/mol
Molecular Formula C25H28N2O5
Exact Mass 436.199822 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID HRAk4h2Hb1O
Name benzoic acid, 4-[(4Z)-4,5-dihydro-4-[(3-methoxy-4-propoxyphenyl)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/C25H28N2O5/c1-6-13-31-22-12-7-18(15-23(22)30-5)14-21-17(4)26-27(24(21)28)20-10-8-19(9-11-20)25(29)32-16(2)3/h7-12,14-16H,6,13H2,1-5H3/b21-14-
InChIKey QDWDFJBXKYGMSE-STZFKDTASA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB3_9000_1482
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/11259696