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3-DIMETHYLAMINO-4-METHYL-5,5-BIS-(TRIFLUOROMETHYL)-2-[2,2,2-TRIFLUORO-1-TRIFLUOROMETHYL-ETHYL]-1H-3-PYRAZOLINE
SpectraBase Compound ID B3I6EHGy73l
InChI InChI=1S/C13H15F12N3/c1-4-27(5-2)7-6(3)9(12(20,21)22,13(23,24)25)26-28(7)8(10(14,15)16)11(17,18)19/h8,26H,4-5H2,1-3H3
InChIKey QJOMSPVBXDZHBC-UHFFFAOYSA-N
Mol Weight 441.26 g/mol
Molecular Formula C13H15F12N3
Exact Mass 441.107435 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EiGGOjGLOJr
Name 3-DIMETHYLAMINO-4-METHYL-5,5-BIS-(TRIFLUOROMETHYL)-2-[2,2,2-TRIFLUORO-1-TRIFLUOROMETHYL-ETHYL]-1H-3-PYRAZOLINE
Compound Number 17J
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H15F12N3
InChI InChI=1S/C13H15F12N3/c1-4-27(5-2)7-6(3)9(12(20,21)22,13(23,24)25)26-28(7)8(10(14,15)16)11(17,18)19/h8,26H,4-5H2,1-3H3
InChIKey QJOMSPVBXDZHBC-UHFFFAOYSA-N
Literature Reference Author K.BURGER,H.SCHICKANEDER,F.HEIN,J.ELGUERO
Literature Reference Citation TETRAHEDRON,35,389(1979)
Literature Reference DOI 10.1016/0040-4020(79)80077-0
Solvent CHCl3
Source File Reference UWPS232