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4-[(3-bromo-5-ethoxy-4-methoxyphenyl)(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 GEsJS8PhOcK
InChI InChI=1S/C32H33BrN4O4/c1-7-41-26-19-22(18-25(33)30(26)40-6)29(27-20(2)34(4)36(31(27)38)23-14-10-8-11-15-23)28-21(3)35(5)37(32(28)39)24-16-12-9-13-17-24/h8-19,29H,7H2,1-6H3
InChIKey OIASWZYCBBRDHO-UHFFFAOYSA-N
Mol Weight 617.5 g/mol
Molecular Formula C32H33BrN4O4
Exact Mass 616.168519 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 60nv5Kl5H5O
Name 4-[(3-bromo-5-ethoxy-4-methoxyphenyl)(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/C32H33BrN4O4/c1-7-41-26-19-22(18-25(33)30(26)40-6)29(27-20(2)34(4)36(31(27)38)23-14-10-8-11-15-23)28-21(3)35(5)37(32(28)39)24-16-12-9-13-17-24/h8-19,29H,7H2,1-6H3
InChIKey OIASWZYCBBRDHO-UHFFFAOYSA-N
NMR Offset 14.9921
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_4011
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/8110783; UBI_ID: UBI-004012
Temperature 308 °C