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3-{{[4-methyl-6-(methylthio)-s-triazin-2-yl]amino}methylene}-1,1,1-trifluoro-2,4-pentanedione

View entire compound with spectra: 2 NMR, and 1 FTIR

3-{{[4-methyl-6-(methylthio)-s-triazin-2-yl]amino}methylene}-1,1,1-trifluoro-2,4-pentanedione
SpectraBase Compound ID LD77wj0fmyt
InChI InChI=1S/C11H11F3N4O2S/c1-5(19)7(8(20)11(12,13)14)4-15-9-16-6(2)17-10(18-9)21-3/h4H,1-3H3,(H,15,16,17,18)
InChIKey ZSHYUMXPANGYRX-UHFFFAOYSA-N
Mol Weight 320.29 g/mol
Molecular Formula C11H11F3N4O2S
Exact Mass 320.055481 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Hdqv39oiK3H
Name 3-{{[4-METHYL-6-(METHYLTHIO)-s-TRIAZIN-2-YL]AMINO}METHYLENE}-1,1,1-TRIFLUORO-2,4-PENTANEDIONE
Source of Sample Maybridge Chemical Company Ltd., North Cornwall, England
Copyright Copyright © 1991-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H11F3N4O2S
InChI InChI=1S/C11H11F3N4O2S/c1-5(19)7(8(20)11(12,13)14)4-15-9-16-6(2)17-10(18-9)21-3/h4H,1-3H3,(H,15,16,17,18)
InChIKey ZSHYUMXPANGYRX-UHFFFAOYSA-N
Instrument Name BRUKER AC-300
Melting Point 53-56C
Molecular Weight 320.30
Solvent CDCl3; Reference=TMS; Temperature 297K