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6,9-DIHYDROXY-4,7-MEGASTIGMADIEN-3-ONE
SpectraBase Compound ID AfkOcMSCIcU
InChI InChI=1S/C13H20O3/c1-9-7-11(15)8-12(3,4)13(9,16)6-5-10(2)14/h5-7,10,14,16H,8H2,1-4H3/b6-5+
InChIKey KPQMCAKZRXOZLB-AATRIKPKSA-N
Mol Weight 224.3 g/mol
Molecular Formula C13H20O3
Exact Mass 224.141245 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 80454PlUixd
Name 6,9-DIHYDROXY-4,7-MEGASTIGMADIEN-3-ONE
Compound Number 12
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H20O3
InChI InChI=1S/C13H20O3/c1-9-7-11(15)8-12(3,4)13(9,16)6-5-10(2)14/h5-7,10,14,16H,8H2,1-4H3/b6-5+
InChIKey KPQMCAKZRXOZLB-AATRIKPKSA-N
Literature Reference Author R.J.GRAYER,M.I.THABREW,R.D.HUGHES,S.BRETHERTON,A.LEVER,N.C.V EITCH,G.C.KITE
Literature Reference Citation PHARM.BIOL.,46,154(2008)
Literature Reference DOI 10.1080/13880200701538682
Molecular Weight 224.300 g/mol
Solvent CD3OD
Source File Reference UWBT16731