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7-(3,5-DICHLOROPHENYLAMINE)-5-METHYL-2-(TRIFLUOROMETHYL)-[1,2,4]-TRIAZOLO-[1,5-A]-PYRIMIDINE
SpectraBase Compound ID 3ABUi8hc7Kc
InChI InChI=1S/C13H8Cl2F3N5/c1-6-2-10(20-9-4-7(14)3-8(15)5-9)23-12(19-6)21-11(22-23)13(16,17)18/h2-5,20H,1H3
InChIKey RGASQOOMWVUPHB-UHFFFAOYSA-N
Mol Weight 362.14 g/mol
Molecular Formula C13H8Cl2F3N5
Exact Mass 361.010885 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IOSHitNSnHt
Name 7-(3,5-DICHLOROPHENYLAMINE)-5-METHYL-2-(TRIFLUOROMETHYL)-[1,2,4]-TRIAZOLO-[1,5-A]-PYRIMIDINE
Compound Number 13
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H8Cl2F3N5
InChI InChI=1S/C13H8Cl2F3N5/c1-6-2-10(20-9-4-7(14)3-8(15)5-9)23-12(19-6)21-11(22-23)13(16,17)18/h2-5,20H,1H3
InChIKey RGASQOOMWVUPHB-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 UWBT1080