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(2E)-3-{3-[(2-bromo-4-chlorophenoxy)methyl]-4-methoxyphenyl}-N-[(1-ethyl-3-methyl-1H-pyrazol-4-yl)methyl]-2-propenamide
SpectraBase Compound ID 1jnXDakuIFd
InChI InChI=1S/C24H25BrClN3O3/c1-4-29-14-19(16(2)28-29)13-27-24(30)10-6-17-5-8-22(31-3)18(11-17)15-32-23-9-7-20(26)12-21(23)25/h5-12,14H,4,13,15H2,1-3H3,(H,27,30)/b10-6+
InChIKey BGUSVKLTDGHRIQ-UXBLZVDNSA-N
Mol Weight 518.84 g/mol
Molecular Formula C24H25BrClN3O3
Exact Mass 517.076782 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 9nuFvxX1b8b
Name (2E)-3-{3-[(2-bromo-4-chlorophenoxy)methyl]-4-methoxyphenyl}-N-[(1-ethyl-3-methyl-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/C24H25BrClN3O3/c1-4-29-14-19(16(2)28-29)13-27-24(30)10-6-17-5-8-22(31-3)18(11-17)15-32-23-9-7-20(26)12-21(23)25/h5-12,14H,4,13,15H2,1-3H3,(H,27,30)/b10-6+
InChIKey BGUSVKLTDGHRIQ-UXBLZVDNSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_3796
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: 9317396; UBI_ID: UBI-003797
Synonyms 3-{3-[(2-bromo-4-chlorophenoxy)methyl]-4-methoxyphenyl}-N-[(1-ethyl-3-methyl-1H-pyrazol-4-yl)methyl]-2-propenamide
Temperature 308 °C