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(4Z)-4-(3-ethoxy-5-iodo-4-isopropoxybenzylidene)-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one

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(4Z)-4-(3-ethoxy-5-iodo-4-isopropoxybenzylidene)-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
SpectraBase Compound ID KhuY2CVwoa9
InChI InChI=1S/C22H23IN2O3/c1-5-27-20-13-16(12-19(23)21(20)28-14(2)3)11-18-15(4)24-25(22(18)26)17-9-7-6-8-10-17/h6-14H,5H2,1-4H3/b18-11-
InChIKey TUTJEHXRHSYESC-WQRHYEAKSA-N
Mol Weight 490.34 g/mol
Molecular Formula C22H23IN2O3
Exact Mass 490.075338 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID AtYzmvPla4s
Name (4Z)-4-(3-ethoxy-5-iodo-4-isopropoxybenzylidene)-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
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/C22H23IN2O3/c1-5-27-20-13-16(12-19(23)21(20)28-14(2)3)11-18-15(4)24-25(22(18)26)17-9-7-6-8-10-17/h6-14H,5H2,1-4H3/b18-11-
InChIKey TUTJEHXRHSYESC-WQRHYEAKSA-N
NMR Offset 14.9921
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_6492
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/8185647; UBI_ID: UBI-006494
Synonyms 4-(3-ethoxy-5-iodo-4-isopropoxybenzylidene)-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
Temperature 308 °C