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5-(alpha,alpha,alpha,alpha',alpha',alpha'-HEXAFLUORO-3,5-XYLYL)-3-{[(2-PYRIMIDINYL)THIO]METHYL}-1,2,4-OXADIAZOLE

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5-(alpha,alpha,alpha,alpha',alpha',alpha'-HEXAFLUORO-3,5-XYLYL)-3-{[(2-PYRIMIDINYL)THIO]METHYL}-1,2,4-OXADIAZOLE
SpectraBase Compound ID E0RJu8gGwio
InChI InChI=1S/C15H8F6N4OS/c16-14(17,18)9-4-8(5-10(6-9)15(19,20)21)12-24-11(25-26-12)7-27-13-22-2-1-3-23-13/h1-6H,7H2
InChIKey HSBKOCVBNAJCKW-UHFFFAOYSA-N
Mol Weight 406.31 g/mol
Molecular Formula C15H8F6N4OS
Exact Mass 406.032301 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID IQIqFOVJ9hy
Name 5-(alpha,alpha,alpha,alpha',alpha',alpha'-HEXAFLUORO-3,5-XYLYL)-3-{[(2-PYRIMIDINYL)THIO]METHYL}-1,2,4-OXADIAZOLE
Source of Sample Maybridge Chemical Company Ltd., North Cornwall, England
Copyright Copyright © 1991-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H8F6N4OS
InChI InChI=1S/C15H8F6N4OS/c16-14(17,18)9-4-8(5-10(6-9)15(19,20)21)12-24-11(25-26-12)7-27-13-22-2-1-3-23-13/h1-6H,7H2
InChIKey HSBKOCVBNAJCKW-UHFFFAOYSA-N
Instrument Name BRUKER AC-300
Melting Point 83-84C
Molecular Weight 406.31
Solvent CDCl3; Reference=TMS; Temperature 297K