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5-HYDROXY-2,2-DIMETHYL-1,7-DIPHENYL-4-TRIFLUOROMETHYL-3-HEPTANONE;SYN-ISOMER
SpectraBase Compound ID Jfsk4L33WWS
InChI InChI=1S/C22H25F3O2/c1-21(2,15-17-11-7-4-8-12-17)20(27)19(22(23,24)25)18(26)14-13-16-9-5-3-6-10-16/h3-12,18-19,26H,13-15H2,1-2H3/t18-,19+/m1/s1
InChIKey YYILIBZNODARFL-MOPGFXCFSA-N
Mol Weight 378.44 g/mol
Molecular Formula C22H25F3O2
Exact Mass 378.180665 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Fvbkh2S9CGy
Name 5-HYDROXY-2,2-DIMETHYL-1,7-DIPHENYL-4-TRIFLUOROMETHYL-3-HEPTANONE;SYN-ISOMER
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H25F3O2
InChI InChI=1S/C22H25F3O2/c1-21(2,15-17-11-7-4-8-12-17)20(27)19(22(23,24)25)18(26)14-13-16-9-5-3-6-10-16/h3-12,18-19,26H,13-15H2,1-2H3/t18-,19+/m1/s1
InChIKey YYILIBZNODARFL-MOPGFXCFSA-N
Literature Reference Author Y.ITOH,M.YAMANAKA,K.MIKAMI
Literature Reference Citation J.AM.CHEM.SOC.,126,13174(2004)
Literature Reference DOI 10.1021/ja046518a
Solvent CDCl3
Source File Reference UWLU34682