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(2E)-3-{3-[(2-bromo-4-chlorophenoxy)methyl]-4-methoxyphenyl}-N-[(1,5-dimethyl-1H-pyrazol-4-yl)methyl]-2-propenamide
SpectraBase Compound ID AYQIxwkPb1H
InChI InChI=1S/C23H23BrClN3O3/c1-15-18(13-27-28(15)2)12-26-23(29)9-5-16-4-7-21(30-3)17(10-16)14-31-22-8-6-19(25)11-20(22)24/h4-11,13H,12,14H2,1-3H3,(H,26,29)/b9-5+
InChIKey ZAUTWXAMHTWZKG-WEVVVXLNSA-N
Mol Weight 504.81 g/mol
Molecular Formula C23H23BrClN3O3
Exact Mass 503.061132 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 44DviHOShmn
Name (2E)-3-{3-[(2-bromo-4-chlorophenoxy)methyl]-4-methoxyphenyl}-N-[(1,5-dimethyl-1H-pyrazol-4-yl)methyl]-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/C23H23BrClN3O3/c1-15-18(13-27-28(15)2)12-26-23(29)9-5-16-4-7-21(30-3)17(10-16)14-31-22-8-6-19(25)11-20(22)24/h4-11,13H,12,14H2,1-3H3,(H,26,29)/b9-5+
InChIKey ZAUTWXAMHTWZKG-WEVVVXLNSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_3794
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: 9317708; UBI_ID: UBI-003795
Synonyms 3-{3-[(2-bromo-4-chlorophenoxy)methyl]-4-methoxyphenyl}-N-[(1,5-dimethyl-1H-pyrazol-4-yl)methyl]-2-propenamide
Temperature 318 °C