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(1'R,3'R,7S,9R)-9-fluoro-7-(3'-hydroxy-1'-methylbutoxy)-11-methoxy-9-methyl-7,8,9,10-tetrahydronaphthacene-5,12-dione
SpectraBase Compound ID 14erdZs7ydW
InChI InChI=1S/C25H27FO5/c1-13(27)9-14(2)31-20-12-25(3,26)11-19-17(20)10-18-21(24(19)30-4)23(29)16-8-6-5-7-15(16)22(18)28/h5-8,10,13-14,20,27H,9,11-12H2,1-4H3/t13-,14-,20-,25+/m1/s1
InChIKey YYHXRLDXNSORKF-SIBMTPJYSA-N
Mol Weight 426.48 g/mol
Molecular Formula C25H27FO5
Exact Mass 426.184252 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 239bhlaTAz
Name (1'R,3'R,7S,9R)-9-FLUORO-7-(3'-HYDROXY-1'-METHYLBUTOXY)-11-METHOXY-9-METHYL-7,8,9,10-TETRAHYDRONAPHTHACENE-5,12-DIONE
Compound Number 21
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C25H27FO5
InChI InChI=1S/C25H27FO5/c1-13(27)9-14(2)31-20-12-25(3,26)11-19-17(20)10-18-21(24(19)30-4)23(29)16-8-6-5-7-15(16)22(18)28/h5-8,10,13-14,20,27H,9,11-12H2,1-4H3/t13-,14-,20-,25+/m1/s1
InChIKey YYHXRLDXNSORKF-SIBMTPJYSA-N
Literature Reference Author R.C.CAMBIE,K.C.HIGGS,J.J.RUSTENHOVEN,P.S.RUTLEDGE
Literature Reference Citation AUSTR.J.CHEM.,49,751(1996)
Molecular Weight 426.485 g/mol
Solvent Unknown
Source File Reference UWRK150176