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7-ALPHA-PERFLUOROHEXYL-1,3,5-[10]-ESTRATRIENE-3,6,17-BETA-TRIOL-3,17-DIACETATE

Compound with spectra: 2 NMR

7-ALPHA-PERFLUOROHEXYL-1,3,5-[10]-ESTRATRIENE-3,6,17-BETA-TRIOL-3,17-DIACETATE
SpectraBase Compound ID 85pjVwli0FP
InChI InChI=1S/C28H27F13O5/c1-11(42)45-13-4-5-14-15-8-9-22(3)17(6-7-18(22)46-12(2)43)19(15)20(21(44)16(14)10-13)23(29,30)24(31,32)25(33,34)26(35,36)27(37,38)28(39,40)41/h4-5,10,15,17-21,44H,6-9H2,1-3H3/t15-,17+,18+,19-,20+,21?,22+/m1/s1
InChIKey WRTPICFOUIBYSC-DHRKMPQISA-N
Mol Weight 690.5 g/mol
Molecular Formula C28H27F13O5
Exact Mass 690.16509 g/mol
Enantiomer InChIKey WRTPICFOUIBYSC-SAAJGICISA-N

View Spectrum of 7-ALPHA-PERFLUOROHEXYL-1,3,5-[10]-ESTRATRIENE-3,6,17-BETA-TRIOL-3,17-DIACETATE

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

View Spectrum of 7-ALPHA-PERFLUOROHEXYL-1,3,5-[10]-ESTRATRIENE-3,6,17-BETA-TRIOL-3,17-DIACETATE

13C NMR Spectrum
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CDCl3
Title Journal or Book Year
Synthesis, Characterization and Biological Evaluation of 7α-Perfluoroalkylestradiol Derivatives Bioorganic & Medicinal Chemistry 2003
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