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N-(4-Bromo-2-trifluoromethyl-phenyl)-2-(pyrimidin-2-ylsulfanyl)-acetamide
SpectraBase Compound ID 5RFGItFCKU9
InChI InChI=1S/C13H9BrF3N3OS/c14-8-2-3-10(9(6-8)13(15,16)17)20-11(21)7-22-12-18-4-1-5-19-12/h1-6H,7H2,(H,20,21)
InChIKey MJVUJDLISDOBQA-UHFFFAOYSA-N
Mol Weight 392.19 g/mol
Molecular Formula C13H9BrF3N3OS
Exact Mass 390.960181 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID LW3DbnvJaMH
Name acetamide, N-[4-bromo-2-(trifluoromethyl)phenyl]-2-(2-pyrimidinylthio)-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 390.960180584 u
Formula C13H9BrF3N3OS
InChI InChI=1S/C13H9BrF3N3OS/c14-8-2-3-10(9(6-8)13(15,16)17)20-11(21)7-22-12-18-4-1-5-19-12/h1-6H,7H2,(H,20,21)
InChIKey MJVUJDLISDOBQA-UHFFFAOYSA-N
Molecular Weight 392.194 g/mol
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_5564
Solvent DMSO-d6
Source Vendor ID: NMR/9322141; Lab Info: PNA; Lab Number: PNA-NA00871
Temperature 29.85 °C