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1-(alpha,alpha,alpha,alpha',alpha',alpha'-HEXAFLUORO-3,5-XYLYL)-3-(6-PHTHALIMIDO-2-PYRIDYL)-2-THIOUREA
SpectraBase Compound ID G8CFkMWE2UK
InChI InChI=1S/C22H12F6N4O2S/c23-21(24,25)11-8-12(22(26,27)28)10-13(9-11)29-20(35)31-16-6-3-7-17(30-16)32-18(33)14-4-1-2-5-15(14)19(32)34/h1-10H,(H2,29,30,31,35)
InChIKey YRHKYOZHWFATGQ-UHFFFAOYSA-N
Mol Weight 510.41 g/mol
Molecular Formula C22H12F6N4O2S
Exact Mass 510.058516 g/mol

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IYxJTpWEZ8d
Name 1-(a,a,a,a',a',a'-hexafluoro-3,5-xylyl)-3-(6-phthalimido-2-pyridyl)-2-thiourea
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Formula C22H12F6N4O2S
InChI InChI=1S/C22H12F6N4O2S/c23-21(24,25)11-8-12(22(26,27)28)10-13(9-11)29-20(35)31-16-6-3-7-17(30-16)32-18(33)14-4-1-2-5-15(14)19(32)34/h1-10H,(H2,29,30,31,35)
InChIKey YRHKYOZHWFATGQ-UHFFFAOYSA-N
Instrument Name Varian CFT-20
Sadtler NMR Number 30891M
Solvent Polysol