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5-HYDROXY-2,2-DIMETHYL-6-METHYL-1-PHENYL-4-TRIFLUOROMETHYL-3-HEPTANONE;ANTI-ISOMER
SpectraBase Compound ID CTtFkPpvL3K
InChI InChI=1S/C17H23F3O2/c1-11(2)14(21)13(17(18,19)20)15(22)16(3,4)10-12-8-6-5-7-9-12/h5-9,11,13-14,21H,10H2,1-4H3/t13-,14-/m0/s1
InChIKey UVQTWJSYJFAVTI-KBPBESRZSA-N
Mol Weight 316.36 g/mol
Molecular Formula C17H23F3O2
Exact Mass 316.165014 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3gSaJWcQwvI
Name 5-HYDROXY-2,2-DIMETHYL-6-METHYL-1-PHENYL-4-TRIFLUOROMETHYL-3-HEPTANONE;ANTI-ISOMER
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H23F3O2
InChI InChI=1S/C17H23F3O2/c1-11(2)14(21)13(17(18,19)20)15(22)16(3,4)10-12-8-6-5-7-9-12/h5-9,11,13-14,21H,10H2,1-4H3/t13-,14-/m0/s1
InChIKey UVQTWJSYJFAVTI-KBPBESRZSA-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 UWLU34678