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3-[(4-bromo-1H-pyrazol-1-yl)methyl]-N-(5-methyl-4-phenyl-1,3-thiazol-2-yl)benzamide
SpectraBase Compound ID FSBOvErghak
InChI InChI=1S/C21H17BrN4OS/c1-14-19(16-7-3-2-4-8-16)24-21(28-14)25-20(27)17-9-5-6-15(10-17)12-26-13-18(22)11-23-26/h2-11,13H,12H2,1H3,(H,24,25,27)
InChIKey WPRLVEKQUJXEKY-UHFFFAOYSA-N
Mol Weight 453.36 g/mol
Molecular Formula C21H17BrN4OS
Exact Mass 452.030645 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Awie3iIJRQO
Name 3-[(4-bromo-1H-pyrazol-1-yl)methyl]-N-(5-methyl-4-phenyl-1,3-thiazol-2-yl)benzamide
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 452.030645356 u
Formula C21H17BrN4OS
InChI InChI=1S/C21H17BrN4OS/c1-14-19(16-7-3-2-4-8-16)24-21(28-14)25-20(27)17-9-5-6-15(10-17)12-26-13-18(22)11-23-26/h2-11,13H,12H2,1H3,(H,24,25,27)
InChIKey WPRLVEKQUJXEKY-UHFFFAOYSA-N
Molecular Weight 453.358 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_9127
Solvent DMSO-d6
Source Vendor ID: NMR/13228378