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acetamide, N-(4-bromophenyl)-2-[[5-(3-fluorophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]thio]-
SpectraBase Compound ID HGkWsmU8qG1
InChI InChI=1S/C22H16BrFN4OS/c23-16-9-11-18(12-10-16)25-20(29)14-30-22-27-26-21(15-5-4-6-17(24)13-15)28(22)19-7-2-1-3-8-19/h1-13H,14H2,(H,25,29)
InChIKey CWTFHQQRHDKENI-UHFFFAOYSA-N
Mol Weight 483.36 g/mol
Molecular Formula C22H16BrFN4OS
Exact Mass 482.021223 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 5uFnCecIWD
Name acetamide, N-(4-bromophenyl)-2-[[5-(3-fluorophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]thio]-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 482.021223487 u
Formula C22H16BrFN4OS
InChI InChI=1S/C22H16BrFN4OS/c23-16-9-11-18(12-10-16)25-20(29)14-30-22-27-26-21(15-5-4-6-17(24)13-15)28(22)19-7-2-1-3-8-19/h1-13H,14H2,(H,25,29)
InChIKey CWTFHQQRHDKENI-UHFFFAOYSA-N
Molecular Weight 483.359 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_13533
Solvent DMSO-d6
Source Vendor ID: NMR/10300057; Lab Info: LP; Lab Number: LP-205246