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ethyl 4-({(E)-[3-methyl-1-(4-methylphenyl)-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]methyl}amino)benzoate
SpectraBase Compound ID FGcCYbUPB4Z
InChI InChI=1S/C21H21N3O3/c1-4-27-21(26)16-7-9-17(10-8-16)22-13-19-15(3)23-24(20(19)25)18-11-5-14(2)6-12-18/h5-13,22H,4H2,1-3H3/b19-13+
InChIKey MIEWRNAOOGJTRO-CPNJWEJPSA-N
Mol Weight 363.42 g/mol
Molecular Formula C21H21N3O3
Exact Mass 363.158292 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Hm12Q9DdrSF
Name ethyl 4-({(E)-[3-methyl-1-(4-methylphenyl)-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]methyl}amino)benzoate
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/C21H21N3O3/c1-4-27-21(26)16-7-9-17(10-8-16)22-13-19-15(3)23-24(20(19)25)18-11-5-14(2)6-12-18/h5-13,22H,4H2,1-3H3/b19-13+
InChIKey MIEWRNAOOGJTRO-CPNJWEJPSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_911
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: 603358RRKR-150; Labnumber: 603358RRKR-150; VK_ID: VK-000912
Synonyms ethyl 4-({[3-methyl-1-(4-methylphenyl)-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]methyl}amino)benzoate
Temperature 308 °C