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5-METHYL-7-(1H-PYRAZOL-1-YL)-2-(TRIFLUOROMETHYL)-[1,2,4]-TRIAZOLO-[1,5-A]-PYRIMIDINE
SpectraBase Compound ID CZ2RKjBCDDM
InChI InChI=1S/C10H7F3N6/c1-6-5-7(18-4-2-3-14-18)19-9(15-6)16-8(17-19)10(11,12)13/h2-5H,1H3
InChIKey HDJILOPAQWASBY-UHFFFAOYSA-N
Mol Weight 268.2 g/mol
Molecular Formula C10H7F3N6
Exact Mass 268.068429 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Al6Hi9msOF7
Name 5-METHYL-7-(1H-PYRAZOL-1-YL)-2-(TRIFLUOROMETHYL)-[1,2,4]-TRIAZOLO-[1,5-A]-PYRIMIDINE
Compound Number 24
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C10H7F3N6
InChI InChI=1S/C10H7F3N6/c1-6-5-7(18-4-2-3-14-18)19-9(15-6)16-8(17-19)10(11,12)13/h2-5H,1H3
InChIKey HDJILOPAQWASBY-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 268.201 g/mol
Sample ID 1089
Solvent CD3OD