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

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(4E)-4-(3-ethoxy-5-iodo-4-methoxybenzylidene)-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
SpectraBase Compound ID BjmHnCmekXt
InChI InChI=1S/C20H19IN2O3/c1-4-26-18-12-14(11-17(21)19(18)25-3)10-16-13(2)22-23(20(16)24)15-8-6-5-7-9-15/h5-12H,4H2,1-3H3/b16-10+
InChIKey DPXMJQMFEPBHRO-MHWRWJLKSA-N
Mol Weight 462.29 g/mol
Molecular Formula C20H19IN2O3
Exact Mass 462.044037 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 90tetYoQ6N
Name (4E)-4-(3-ethoxy-5-iodo-4-methoxybenzylidene)-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/C20H19IN2O3/c1-4-26-18-12-14(11-17(21)19(18)25-3)10-16-13(2)22-23(20(16)24)15-8-6-5-7-9-15/h5-12H,4H2,1-3H3/b16-10+
InChIKey DPXMJQMFEPBHRO-MHWRWJLKSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_34344
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: 7107574; SBI_ID: SBI-034348
Synonyms 4-(3-ethoxy-5-iodo-4-methoxybenzylidene)-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
Temperature 308 °C