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4-[(2-butoxyphenyl)(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 9hwHbHUTuuG
InChI InChI=1S/C33H36N4O3/c1-6-7-22-40-28-21-15-14-20-27(28)31(29-23(2)34(4)36(32(29)38)25-16-10-8-11-17-25)30-24(3)35(5)37(33(30)39)26-18-12-9-13-19-26/h8-21,31H,6-7,22H2,1-5H3
InChIKey SRFHOWZMNBSRRW-UHFFFAOYSA-N
Mol Weight 536.7 g/mol
Molecular Formula C33H36N4O3
Exact Mass 536.278741 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 3rYxaah6Bu6
Name 4-[(2-butoxyphenyl)(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/C33H36N4O3/c1-6-7-22-40-28-21-15-14-20-27(28)31(29-23(2)34(4)36(32(29)38)25-16-10-8-11-17-25)30-24(3)35(5)37(33(30)39)26-18-12-9-13-19-26/h8-21,31H,6-7,22H2,1-5H3
InChIKey SRFHOWZMNBSRRW-UHFFFAOYSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_5121
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/8014267; Labnumber: BMW-78678; UZI_ID: UZI-005123
Temperature 308 °C