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(2E)-3-{3-[(2-bromo-4-chlorophenoxy)methyl]-4-methoxyphenyl}-N-[1-(2,6-dichlorobenzyl)-3,5-dimethyl-1H-pyrazol-4-yl]-2-propenamide
SpectraBase Compound ID DdsP3AQ0lui
InChI InChI=1S/C29H25BrCl3N3O3/c1-17-29(18(2)36(35-17)15-22-24(32)5-4-6-25(22)33)34-28(37)12-8-19-7-10-26(38-3)20(13-19)16-39-27-11-9-21(31)14-23(27)30/h4-14H,15-16H2,1-3H3,(H,34,37)/b12-8+
InChIKey INTVUUFRBQVTOC-XYOKQWHBSA-N
Mol Weight 649.8 g/mol
Molecular Formula C29H25BrCl3N3O3
Exact Mass 647.014488 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Ed5qHRfcxyo
Name (2E)-3-{3-[(2-bromo-4-chlorophenoxy)methyl]-4-methoxyphenyl}-N-[1-(2,6-dichlorobenzyl)-3,5-dimethyl-1H-pyrazol-4-yl]-2-propenamide
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/C29H25BrCl3N3O3/c1-17-29(18(2)36(35-17)15-22-24(32)5-4-6-25(22)33)34-28(37)12-8-19-7-10-26(38-3)20(13-19)16-39-27-11-9-21(31)14-23(27)30/h4-14H,15-16H2,1-3H3,(H,34,37)/b12-8+
InChIKey INTVUUFRBQVTOC-XYOKQWHBSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_3439
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: 9315089; UBI_ID: UBI-003440
Synonyms 3-{3-[(2-bromo-4-chlorophenoxy)methyl]-4-methoxyphenyl}-N-[1-(2,6-dichlorobenzyl)-3,5-dimethyl-1H-pyrazol-4-yl]-2-propenamide
Temperature 318 °C