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7-METHYL-3-(TRIFLUOROMETHYL)-5,6,7,8-TETRAHYDRO-[1,2,4]-TRIAZOLO-[4,3-A]-PYRAZINE-HYDROCHLORIDE
SpectraBase Compound ID H1hxU1A8OlV
InChI InChI=1S/C7H9ClF3N4/c1-14-2-3-15(8)5(4-14)12-13-6(15)7(9,10)11/h2-4H2,1H3
InChIKey ACTKCXDYYFMZSU-UHFFFAOYSA-N
Mol Weight 241.63 g/mol
Molecular Formula C7H9ClF3N4
Exact Mass 241.046783 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8tPmQYywf2k
Name 7-METHYL-3-(TRIFLUOROMETHYL)-5,6,7,8-TETRAHYDRO-[1,2,4]-TRIAZOLO-[4,3-A]-PYRAZINE-HYDROCHLORIDE
Compound Number 1F
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C7H9ClF3N4
InChI InChI=1S/C7H9ClF3N4/c1-14-2-3-15(8)5(4-14)12-13-6(15)7(9,10)11/h2-4H2,1H3
InChIKey ACTKCXDYYFMZSU-UHFFFAOYSA-N
Literature Reference Author J.BALSELLS,L.DIMICHELE,J.LIU,M.KUBRYK,K.HANSEN,J.D.ARMSTRONG
Literature Reference Citation ORG.LETTERS,7,1039(2005)
Literature Reference DOI 10.1021/ol0474406
Molecular Weight 241.623 g/mol
Sample ID 62236
Solvent CD3OD