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TRANS-(4,6-DIMETHYLPYRIMIDYN-2-YL)THIOPERFLUOROHEXENE
SpectraBase Compound ID 2DgVm1pNulR
InChI InChI=1S/C12H7F11N2S/c1-4-3-5(2)25-8(24-4)26-7(14)6(13)9(15,16)10(17,18)11(19,20)12(21,22)23/h3H,1-2H3/b7-6-
InChIKey VLUWAGQPBKHWPC-SREVYHEPSA-N
Mol Weight 420.24 g/mol
Molecular Formula C12H7F11N2S
Exact Mass 420.015429 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6pHwY6mFc9Y
Name TRANS-(4,6-DIMETHYLPYRIMIDYN-2-YL)THIOPERFLUOROHEXENE
Comments SCALE INVERTED
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Formula C12H7F11N2S
InChI InChI=1S/C12H7F11N2S/c1-4-3-5(2)25-8(24-4)26-7(14)6(13)9(15,16)10(17,18)11(19,20)12(21,22)23/h3H,1-2H3/b7-6-
InChIKey VLUWAGQPBKHWPC-SREVYHEPSA-N
Instrument Name Tesla BS487
Literature Reference T.A.DASHEVSKAYA, YU.A.FIALKOV, V.A.KHRANOVSKY, V.M.CHERKASOV (1984)Khim.Heteroc.Soed.(Russ. Lang.): N3, 402-406.
NMR Standard -CF3COOH external
Observed nucleus 19F
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent not reported