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1H-pyrazole-3-acetic acid, 4-[1-[[(2-chlorophenyl)methyl]amino]ethylidene]-4,5-dihydro-1-(4-methoxyphenyl)-5-oxo-, methyl ester, (4Z)-

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1H-pyrazole-3-acetic acid, 4-[1-[[(2-chlorophenyl)methyl]amino]ethylidene]-4,5-dihydro-1-(4-methoxyphenyl)-5-oxo-, methyl ester, (4Z)-
SpectraBase Compound ID 6JcBReL73KQ
InChI InChI=1S/C22H22ClN3O4/c1-14(24-13-15-6-4-5-7-18(15)23)21-19(12-20(27)30-3)25-26(22(21)28)16-8-10-17(29-2)11-9-16/h4-11,24H,12-13H2,1-3H3/b21-14-
InChIKey ONCQTPBJUUZLHF-STZFKDTASA-N
Mol Weight 427.89 g/mol
Molecular Formula C22H22ClN3O4
Exact Mass 427.129884 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID KYvcTODUt8q
Name 1H-pyrazole-3-acetic acid, 4-[1-[[(2-chlorophenyl)methyl]amino]ethylidene]-4,5-dihydro-1-(4-methoxyphenyl)-5-oxo-, methyl ester, (4Z)-
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/C22H22ClN3O4/c1-14(24-13-15-6-4-5-7-18(15)23)21-19(12-20(27)30-3)25-26(22(21)28)16-8-10-17(29-2)11-9-16/h4-11,24H,12-13H2,1-3H3/b21-14-
InChIKey ONCQTPBJUUZLHF-STZFKDTASA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_11628_915
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: F06827; Labnumber: VGU-77586
Temperature 308 °C