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(3R*,4R*)-3,4-EPOXY-4-(HYDROXYDIPHENYL)-METHYL-1-PHENYL-3-TRIFLUOROMETHYL-OCT-1-YNE
SpectraBase Compound ID DEQXvghQgb
InChI InChI=1S/C28H25F3O2/c1-2-3-20-25(26(33-25,28(29,30)31)21-19-22-13-7-4-8-14-22)27(32,23-15-9-5-10-16-23)24-17-11-6-12-18-24/h4-18,32H,2-3,20H2,1H3/t25-,26+/m1/s1
InChIKey YGHWRKCKPKJGBY-FTJBHMTQSA-N
Mol Weight 450.5 g/mol
Molecular Formula C28H25F3O2
Exact Mass 450.180665 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JDnHsgAHuL6
Name (3R*,4R*)-3,4-EPOXY-4-(HYDROXYDIPHENYL)-METHYL-1-PHENYL-3-TRIFLUOROMETHYL-OCT-1-YNE
Compound Number 3K
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C28H25F3O2
InChI InChI=1S/C28H25F3O2/c1-2-3-20-25(26(33-25,28(29,30)31)21-19-22-13-7-4-8-14-22)27(32,23-15-9-5-10-16-23)24-17-11-6-12-18-24/h4-18,32H,2-3,20H2,1H3/t25-,26+/m1/s1
InChIKey YGHWRKCKPKJGBY-FTJBHMTQSA-N
Literature Reference Author M.SHIMIZU,T.FUJIMOTO,H.MINEZAKI,T.HATA,T.HIYAMA
Literature Reference Citation J.AM.CHEM.SOC.,123,6947(2001)
Literature Reference DOI 10.1021/ja016077k
Solvent CDCl3
Source File Reference UWVN28078