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4-METHYL-N-[4-(TRICHLOROMETHYL)-PYRIMIDIN-2-YL]-6-(TRIFLUOROMETHYL)-PYRIMIDIN-2-AMINE
SpectraBase Compound ID 7WjskLToW0A
InChI InChI=1S/C11H7Cl3F3N5/c1-5-4-7(11(15,16)17)21-9(19-5)22-8-18-3-2-6(20-8)10(12,13)14/h2-4H,1H3,(H,18,19,20,21,22)
InChIKey AGTUJDNNSTVTRF-UHFFFAOYSA-N
Mol Weight 372.57 g/mol
Molecular Formula C11H7Cl3F3N5
Exact Mass 370.971913 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FRzWbBMB9dG
Name 4-METHYL-N-[4-(TRICHLOROMETHYL)-PYRIMIDIN-2-YL]-6-(TRIFLUOROMETHYL)-PYRIMIDIN-2-AMINE
Compound Number 4B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C11H7Cl3F3N5
InChI InChI=1S/C11H7Cl3F3N5/c1-5-4-7(11(15,16)17)21-9(19-5)22-8-18-3-2-6(20-8)10(12,13)14/h2-4H,1H3,(H,18,19,20,21,22)
InChIKey AGTUJDNNSTVTRF-UHFFFAOYSA-N
Literature Reference Author N.ZANNATTA,E.C.S.LOPES,L.FANTINEL,H.G.BONACORSO,M.A.P.MARTIN S
Literature Reference Citation J.HETCYCL.CHEM.,39,943(2002)
Literature Reference DOI 10.1002/jhet.5570390514
Molecular Weight 372.564 g/mol
Solvent CDCl3
Source File Reference UWSI19156