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4-bromo-1-{4-[(2-chlorophenoxy)methyl]benzoyl}-3,5-dimethyl-1H-pyrazole
SpectraBase Compound ID GXJBJC80AYM
InChI InChI=1S/C19H16BrClN2O2/c1-12-18(20)13(2)23(22-12)19(24)15-9-7-14(8-10-15)11-25-17-6-4-3-5-16(17)21/h3-10H,11H2,1-2H3
InChIKey PKGJAENDZWQUHW-UHFFFAOYSA-N
Mol Weight 419.71 g/mol
Molecular Formula C19H16BrClN2O2
Exact Mass 418.008368 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 9YlEBGkKXpm
Name 4-bromo-1-{4-[(2-chlorophenoxy)methyl]benzoyl}-3,5-dimethyl-1H-pyrazole
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 418.008368461 u
Formula C19H16BrClN2O2
InChI InChI=1S/C19H16BrClN2O2/c1-12-18(20)13(2)23(22-12)19(24)15-9-7-14(8-10-15)11-25-17-6-4-3-5-16(17)21/h3-10H,11H2,1-2H3
InChIKey PKGJAENDZWQUHW-UHFFFAOYSA-N
Molecular Weight 419.706 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_9125
Solvent DMSO-d6
Source Vendor ID: NMR/13228373