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N-(4-bromophenyl)-2-{[4-phenyl-5-(4-pyridinyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
SpectraBase Compound ID HeQAZRi0roE
InChI InChI=1S/C21H16BrN5OS/c22-16-6-8-17(9-7-16)24-19(28)14-29-21-26-25-20(15-10-12-23-13-11-15)27(21)18-4-2-1-3-5-18/h1-13H,14H2,(H,24,28)
InChIKey BHJXQFGYWQHMGO-UHFFFAOYSA-N
Mol Weight 466.36 g/mol
Molecular Formula C21H16BrN5OS
Exact Mass 465.025894 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID FmrfHH57mSC
Name N-(4-bromophenyl)-2-{[4-phenyl-5-(4-pyridinyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 465.025894328 u
Formula C21H16BrN5OS
InChI InChI=1S/C21H16BrN5OS/c22-16-6-8-17(9-7-16)24-19(28)14-29-21-26-25-20(15-10-12-23-13-11-15)27(21)18-4-2-1-3-5-18/h1-13H,14H2,(H,24,28)
InChIKey BHJXQFGYWQHMGO-UHFFFAOYSA-N
Molecular Weight 466.357 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_1241
Solvent DMSO-d6
Source Vendor ID: NMR/12269399