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4,4'-((4-chlorophenyl)methylene)bis(1,5-dimethyl-2-phenyl-1H-pyrazol-3(2H)-one)

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4,4'-((4-chlorophenyl)methylene)bis(1,5-dimethyl-2-phenyl-1H-pyrazol-3(2H)-one)
SpectraBase Compound ID GAJhmA8s6Wn
InChI InChI=1S/C29H27ClN4O2/c1-19-25(28(35)33(31(19)3)23-11-7-5-8-12-23)27(21-15-17-22(30)18-16-21)26-20(2)32(4)34(29(26)36)24-13-9-6-10-14-24/h5-18,27H,1-4H3
InChIKey AHLSOESUETYWBK-UHFFFAOYSA-N
Mol Weight 499.01 g/mol
Molecular Formula C29H27ClN4O2
Exact Mass 498.182254 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID DI35vuo4VGg
Name 4-[(4-chlorophenyl)(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/C29H27ClN4O2/c1-19-25(28(35)33(31(19)3)23-11-7-5-8-12-23)27(21-15-17-22(30)18-16-21)26-20(2)32(4)34(29(26)36)24-13-9-6-10-14-24/h5-18,27H,1-4H3
InChIKey AHLSOESUETYWBK-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_20793
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: H07306; Labnumber: RB3-025; SBI_ID: SBI-020797
Temperature 315 °C