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4H-1,2,4-triazole, 3-[[(4-bromophenyl)methyl]thio]-5-(3,4-dimethoxyphenyl)-4-phenyl-
SpectraBase Compound ID 8hDZxYEInpt
InChI InChI=1S/C23H20BrN3O2S/c1-28-20-13-10-17(14-21(20)29-2)22-25-26-23(27(22)19-6-4-3-5-7-19)30-15-16-8-11-18(24)12-9-16/h3-14H,15H2,1-2H3
InChIKey FIMROYJEPULGHA-UHFFFAOYSA-N
Mol Weight 482.4 g/mol
Molecular Formula C23H20BrN3O2S
Exact Mass 481.045961 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 6eB5JJKd8RP
Name 4H-1,2,4-triazole, 3-[[(4-bromophenyl)methyl]thio]-5-(3,4-dimethoxyphenyl)-4-phenyl-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 481.045961068 u
Formula C23H20BrN3O2S
InChI InChI=1S/C23H20BrN3O2S/c1-28-20-13-10-17(14-21(20)29-2)22-25-26-23(27(22)19-6-4-3-5-7-19)30-15-16-8-11-18(24)12-9-16/h3-14H,15H2,1-2H3
InChIKey FIMROYJEPULGHA-UHFFFAOYSA-N
Molecular Weight 482.396 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_13406
Solvent DMSO-d6
Source Vendor ID: NMR/10300142; Lab Info: LP; Lab Number: LP-207406