John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=Gb6gxBwL6e6 SpectraBase Spectrum ID=2bfjTUtd95a

(accessed ).
7-CHLORO-5-METHYL-2-(TRIFLUOROMETHYL)-[1,2,4]-TRIAZOLO-[1,5-A]-PYRIMIDINE
SpectraBase Compound ID Gb6gxBwL6e6
InChI InChI=1S/C7H4ClF3N4/c1-3-2-4(8)15-6(12-3)13-5(14-15)7(9,10)11/h2H,1H3
InChIKey ZPRYBESGXFDOSK-UHFFFAOYSA-N
Mol Weight 236.59 g/mol
Molecular Formula C7H4ClF3N4
Exact Mass 236.007659 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2bfjTUtd95a
Name 7-CHLORO-5-METHYL-2-(TRIFLUOROMETHYL)-[1,2,4]-TRIAZOLO-[1,5-A]-PYRIMIDINE
Compound Number 3C
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C7H4ClF3N4
InChI InChI=1S/C7H4ClF3N4/c1-3-2-4(8)15-6(12-3)13-5(14-15)7(9,10)11/h2H,1H3
InChIKey ZPRYBESGXFDOSK-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 UWBT1069
SpectraBase Batch ID 9xuHX8mABSc