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4-methyl-3-[(2-nitro-alpha,alpha,alpha-trifluoro-p-tolyl)thio]-5-[2-(3-pyridyl)-4-thiazolyl]-4H-1,2,4-triazole
SpectraBase Compound ID 5qnPJfZtijH
InChI InChI=1S/C18H11F3N6O2S2/c1-26-15(12-9-30-16(23-12)10-3-2-6-22-8-10)24-25-17(26)31-14-5-4-11(18(19,20)21)7-13(14)27(28)29/h2-9H,1H3
InChIKey PTGAXMMQDOIODA-UHFFFAOYSA-N
Mol Weight 464.44 g/mol
Molecular Formula C18H11F3N6O2S2
Exact Mass 464.0337 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 3Xetf8gTrp0
Name 4-METHYL-3-[(2-NITRO-alpha,alpha,alpha-TRIFLUORO-p-TOLYL)THIO]-5-[2-(3-PYRIDYL)-4-THIAZOLYL]-4H-1,2,4-TRIAZOLE
Source of Sample Maybridge Chemical Company Ltd., North Cornwall, England
Copyright Copyright © 1991-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H11F3N6O2S2
InChI InChI=1S/C18H11F3N6O2S2/c1-26-15(12-9-30-16(23-12)10-3-2-6-22-8-10)24-25-17(26)31-14-5-4-11(18(19,20)21)7-13(14)27(28)29/h2-9H,1H3
InChIKey PTGAXMMQDOIODA-UHFFFAOYSA-N
Instrument Name BRUKER AC-300
Melting Point 234-236C
Molecular Weight 464.45
Solvent CDCl3; Reference=TMS; Temperature 297K