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#12-ALPHA+13-ALPHA;MAJOR-ISOMER;(1S,1R)-2,2,2-TRIFLUORO-1-[(1S,4R,5S,8R,9R,11S,12S)-1,5,9-TRIMETHYL-10,13,14,15-TETRAOXATETRACYCLO-[9.3.1.0.(4,12)0(8,12)]-PENT

Compound with spectra: 4 NMR

#12-ALPHA+13-ALPHA;MAJOR-ISOMER;(1S,1R)-2,2,2-TRIFLUORO-1-[(1S,4R,5S,8R,9R,11S,12S)-1,5,9-TRIMETHYL-10,13,14,15-TETRAOXATETRACYCLO-[9.3.1.0.(4,12)0(8,12)]-PENT
SpectraBase Compound ID JHFs9ulNjds
InChI InChI=1S/C16H23F3O5/c1-8-4-5-10-14(3,11(20)16(17,18)19)22-12-15(10)9(8)6-7-13(2,21-12)23-24-15/h8-12,20H,4-7H2,1-3H3/t8-,9+,10+,11+,12+,13-,14-,15-/m1/s1
InChIKey UFLWWNUYRKMMTA-FVTRGHSBSA-N
Mol Weight 352.35 g/mol
Molecular Formula C16H23F3O5
Exact Mass 352.149758 g/mol
Enantiomer InChIKey UFLWWNUYRKMMTA-CCFYCRQCSA-N

View Spectrum of #12-ALPHA+13-ALPHA;MAJOR-ISOMER;(1S,1R)-2,2,2-TRIFLUORO-1-[(1S,4R,5S,8R,9R,11S,12S)-1,5,9-TRIMETHYL-10,13,14,15-TETRAOXATETRACYCLO-[9.3.1.0.(4,12)0(8,12)]-PENT

19F NMR Spectrum
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CDCl3

View Spectrum of #12-ALPHA+13-ALPHA;MAJOR-ISOMER;(1S,1R)-2,2,2-TRIFLUORO-1-[(1S,4R,5S,8R,9R,11S,12S)-1,5,9-TRIMETHYL-10,13,14,15-TETRAOXATETRACYCLO-[9.3.1.0.(4,12)0(8,12)]-PENT

19F NMR Spectrum
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CDCl3

View Spectrum of #12-ALPHA+13-ALPHA;MAJOR-ISOMER;(1S,1R)-2,2,2-TRIFLUORO-1-[(1S,4R,5S,8R,9R,11S,12S)-1,5,9-TRIMETHYL-10,13,14,15-TETRAOXATETRACYCLO-[9.3.1.0.(4,12)0(8,12)]-PENT

13C NMR Spectrum
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CDCl3

View Spectrum of #12-ALPHA+13-ALPHA;MAJOR-ISOMER;(1S,1R)-2,2,2-TRIFLUORO-1-[(1S,4R,5S,8R,9R,11S,12S)-1,5,9-TRIMETHYL-10,13,14,15-TETRAOXATETRACYCLO-[9.3.1.0.(4,12)0(8,12)]-PENT

13C NMR Spectrum
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CDCl3
  • #12-ALPHA+13-ALPHA;MINOR-ISOMER;(1S,1R)-2,2,2-TRIFLUORO-1-[(1S,4R,5S,8R,9R,11S,12S)-1,5,9-TRIMETHYL-10,13,14,15-TETRAOXATETRACYCLO-[9.3.1.0.(4,12)0(8,12)]-PENT
#12-BETA+13-BETA;MAJOR-ISOMER;(1S,1R)-2,2,2-TRIFLUORO-1-[(1S,4R,5S,8R,9S,11S,12S)-1,5,9-TRIMETHYL-10,13,14,15-TETRAOXATETRACYCLO-[9.3.1.0.(4,12)0(8,12)]-PENTAD
Title Journal or Book Year
Anhydrodihydroartemisinin and Its 10-Trifluoromethyl Analogue:  Access to Novel D-Ring-Contracted Artemisinin Trifluoromethyl Ketones The Journal of Organic Chemistry 2002
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