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4-[(3-chloro-4,5-dimethoxyphenyl)(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)methyl]-1,5-dimethyl-2-phenyl-1,2-dihydro-3H-pyrazol-3-one

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4-[(3-chloro-4,5-dimethoxyphenyl)(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)methyl]-1,5-dimethyl-2-phenyl-1,2-dihydro-3H-pyrazol-3-one
SpectraBase Compound ID Di49HuIP91
InChI InChI=1S/C31H31ClN4O4/c1-19-26(30(37)35(33(19)3)22-13-9-7-10-14-22)28(21-17-24(32)29(40-6)25(18-21)39-5)27-20(2)34(4)36(31(27)38)23-15-11-8-12-16-23/h7-18,28H,1-6H3
InChIKey JQCNAEHZGWWWHT-UHFFFAOYSA-N
Mol Weight 559.07 g/mol
Molecular Formula C31H31ClN4O4
Exact Mass 558.203383 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID JESl83swtgO
Name 4-[(3-chloro-4,5-dimethoxyphenyl)(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)methyl]-1,5-dimethyl-2-phenyl-1,2-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/C31H31ClN4O4/c1-19-26(30(37)35(33(19)3)22-13-9-7-10-14-22)28(21-17-24(32)29(40-6)25(18-21)39-5)27-20(2)34(4)36(31(27)38)23-15-11-8-12-16-23/h7-18,28H,1-6H3
InChIKey JQCNAEHZGWWWHT-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_5063
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/8105556; Labnumber: BMW-116853s; UZI_ID: UZI-005065
Temperature 318 °C