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7-(4-METHOXYPHENYLAMINE)-5-METHYL-2-(TRIFLUOROMETHYL)-[1,2,4]-TRIAZOLO-[1,5-A]-PYRIMIDINE
SpectraBase Compound ID 9I8CYnZ4scp
InChI InChI=1S/C14H12F3N5O/c1-8-7-11(19-9-3-5-10(23-2)6-4-9)22-13(18-8)20-12(21-22)14(15,16)17/h3-7,19H,1-2H3
InChIKey QYDSYITWNDRVPY-UHFFFAOYSA-N
Mol Weight 323.28 g/mol
Molecular Formula C14H12F3N5O
Exact Mass 323.099395 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CtFR5RV0i4f
Name 7-(4-METHOXYPHENYLAMINE)-5-METHYL-2-(TRIFLUOROMETHYL)-[1,2,4]-TRIAZOLO-[1,5-A]-PYRIMIDINE
Compound Number 11
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C14H12F3N5O
InChI InChI=1S/C14H12F3N5O/c1-8-7-11(19-9-3-5-10(23-2)6-4-9)22-13(18-8)20-12(21-22)14(15,16)17/h3-7,19H,1-2H3
InChIKey QYDSYITWNDRVPY-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
Molecular Weight 323.277 g/mol
Sample ID 1078
Solvent CD3OD