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Acetamide, 2-(4-trifluoromethyl-6-methyl-2-pyrimidylthio)-N-(5-methyl-3-isoxazolyl)-

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Acetamide, 2-(4-trifluoromethyl-6-methyl-2-pyrimidylthio)-N-(5-methyl-3-isoxazolyl)-
SpectraBase Compound ID 5pS5y7d9d4r
InChI InChI=1S/C12H11F3N4O2S/c1-6-3-8(12(13,14)15)17-11(16-6)22-5-10(20)18-9-4-7(2)21-19-9/h3-4H,5H2,1-2H3,(H,18,19,20)
InChIKey MHJXWXVJOUVQLA-UHFFFAOYSA-N
Mol Weight 332.3 g/mol
Molecular Formula C12H11F3N4O2S
Exact Mass 332.055481 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 6C310HoUgwy
Name acetamide, N-(5-methyl-3-isoxazolyl)-2-[[4-methyl-6-(trifluoromethyl)-2-pyrimidinyl]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 332.055481271 u
Formula C12H11F3N4O2S
InChI InChI=1S/C12H11F3N4O2S/c1-6-3-8(12(13,14)15)17-11(16-6)22-5-10(20)18-9-4-7(2)21-19-9/h3-4H,5H2,1-2H3,(H,18,19,20)
InChIKey MHJXWXVJOUVQLA-UHFFFAOYSA-N
Molecular Weight 332.301 g/mol
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_8832
Solvent DMSO-d6
Source Vendor ID: NMR/10230872; Lab Info: PNA; Lab Number: PNA-NA01026
Temperature 29.85 °C