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(2-ethoxy-4-{(Z)-[3-methyl-1-(4-methylphenyl)-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]methyl}phenoxy)acetonitrile
SpectraBase Compound ID Grfym1le78S
InChI InChI=1S/C22H21N3O3/c1-4-27-21-14-17(7-10-20(21)28-12-11-23)13-19-16(3)24-25(22(19)26)18-8-5-15(2)6-9-18/h5-10,13-14H,4,12H2,1-3H3/b19-13-
InChIKey BXJFHWUSUZXVCU-UYRXBGFRSA-N
Mol Weight 375.43 g/mol
Molecular Formula C22H21N3O3
Exact Mass 375.158292 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 7yEC5af562l
Name (2-ethoxy-4-{(Z)-[3-methyl-1-(4-methylphenyl)-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]methyl}phenoxy)acetonitrile
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/C22H21N3O3/c1-4-27-21-14-17(7-10-20(21)28-12-11-23)13-19-16(3)24-25(22(19)26)18-8-5-15(2)6-9-18/h5-10,13-14H,4,12H2,1-3H3/b19-13-
InChIKey BXJFHWUSUZXVCU-UYRXBGFRSA-N
NMR Offset 14.9921
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_6743
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/8186952; UBI_ID: UBI-006745
Synonyms (2-ethoxy-4-{[3-methyl-1-(4-methylphenyl)-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]methyl}phenoxy)acetonitrile
Temperature 313 °C