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5-METHYL-7-(NAPHTHALEN-2-YLAMINE)-2-(TRIFLUOROMETHYL)-[1,2,4]-TRIAZOLO-[1,5-A]-PYRIMIDINE
SpectraBase Compound ID 7HYy1UhyAW6
InChI InChI=1S/C17H12F3N5/c1-10-8-14(25-16(21-10)23-15(24-25)17(18,19)20)22-13-7-6-11-4-2-3-5-12(11)9-13/h2-9,22H,1H3
InChIKey ZLKAPPDHSYUHHR-UHFFFAOYSA-N
Mol Weight 343.31 g/mol
Molecular Formula C17H12F3N5
Exact Mass 343.10448 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9oUSOB81E0I
Name 5-METHYL-7-(NAPHTHALEN-2-YLAMINE)-2-(TRIFLUOROMETHYL)-[1,2,4]-TRIAZOLO-[1,5-A]-PYRIMIDINE
Compound Number 5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H12F3N5
InChI InChI=1S/C17H12F3N5/c1-10-8-14(25-16(21-10)23-15(24-25)17(18,19)20)22-13-7-6-11-4-2-3-5-12(11)9-13/h2-9,22H,1H3
InChIKey ZLKAPPDHSYUHHR-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 UWBT1072