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5-HYDROXY-1-METHYL-4-(3-METHYLAMINOPROPYL)-3-TRIFLUOROMETHYLPYRAZOLE
SpectraBase Compound ID Fj85PgSXWmG
InChI InChI=1S/C9H14F3N3O/c1-13-5-3-4-6-7(9(10,11)12)14-15(2)8(6)16/h13,16H,3-5H2,1-2H3
InChIKey PLUKQVYYFBKTQE-UHFFFAOYSA-N
Mol Weight 237.23 g/mol
Molecular Formula C9H14F3N3O
Exact Mass 237.108897 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BQC2ec5rXyt
Name 5-HYDROXY-1-METHYL-4-(3-METHYLAMINOPROPYL)-3-TRIFLUOROMETHYLPYRAZOLE
Compound Number 15F
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C9H14F3N3O
InChI InChI=1S/C9H14F3N3O/c1-13-5-3-4-6-7(9(10,11)12)14-15(2)8(6)16/h13,16H,3-5H2,1-2H3
InChIKey PLUKQVYYFBKTQE-UHFFFAOYSA-N
Literature Reference Author J.P.BOUILLON,A.M.FRISQUE-HESBAIN,Z.JANOUSEK,H.G.VIEHE
Literature Reference Citation HETEROCYCLES,40,661(1995)
Literature Reference DOI 10.3987/COM-94-S55
Solvent CD3OD
Source File Reference UWCP8032