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5-METHYL-7-(4-METHYLPIPERAZIN-1-YL)-2-(TRIFLUOROMETHYL)-[1,2,4]-TRIAZOLO-[1,5-A]-PYRIMIDINE
SpectraBase Compound ID HASOHTl7Hx6
InChI InChI=1S/C12H15F3N6/c1-8-7-9(20-5-3-19(2)4-6-20)21-11(16-8)17-10(18-21)12(13,14)15/h7H,3-6H2,1-2H3
InChIKey OEYFUIBJWFDBBT-UHFFFAOYSA-N
Mol Weight 300.29 g/mol
Molecular Formula C12H15F3N6
Exact Mass 300.131029 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DQBDs3gP5De
Name 5-METHYL-7-(4-METHYLPIPERAZIN-1-YL)-2-(TRIFLUOROMETHYL)-[1,2,4]-TRIAZOLO-[1,5-A]-PYRIMIDINE
Compound Number 20
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H15F3N6
InChI InChI=1S/C12H15F3N6/c1-8-7-9(20-5-3-19(2)4-6-20)21-11(16-8)17-10(18-21)12(13,14)15/h7H,3-6H2,1-2H3
InChIKey OEYFUIBJWFDBBT-UHFFFAOYSA-N
Literature Reference Author N.BOECHAT,L.C.S.PINHEIRO,T.S.SILVA,A.C.C.AGUIAR,A.S.CARVALHO ,M.M.BASTOS,C.C.P.CO
Literature Reference Citation MOLECULES,17,8285(2012)
Literature Reference DOI 10.3390/molecules17078285
Solvent CD3OD
Source File Reference UWBT1085