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METHYL-6-HYDROXY-3-METHOXY-11-METHYL-17-OXO-11-AZAESTRA-1,3,5(10)-TRIENE-6-CARBOXYLATE
SpectraBase Compound ID DNuCDef8TpK
InChI InChI=1S/C21H27NO5/c1-20-11-22(2)18-13-6-5-12(26-3)9-16(13)21(25,19(24)27-4)10-14(18)15(20)7-8-17(20)23/h5-6,9,14-15,18,25H,7-8,10-11H2,1-4H3/t14-,15-,18+,20-,21-/m0/s1
InChIKey XLSSVNOMKAZDPA-JUYJLUJKSA-N
Mol Weight 373.45 g/mol
Molecular Formula C21H27NO5
Exact Mass 373.188923 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DUwHCAx0DFv
Name METHYL-6-HYDROXY-3-METHOXY-11-METHYL-17-OXO-11-AZAESTRA-1,3,5(10)-TRIENE-6-CARBOXYLATE
Compound Number 24
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H27NO5
InChI InChI=1S/C21H27NO5/c1-20-11-22(2)18-13-6-5-12(26-3)9-16(13)21(25,19(24)27-4)10-14(18)15(20)7-8-17(20)23/h5-6,9,14-15,18,25H,7-8,10-11H2,1-4H3/t14-,15-,18+,20-,21-/m0/s1
InChIKey XLSSVNOMKAZDPA-JUYJLUJKSA-N
Literature Reference Author O.PETERS,T.DEBAERDEMAEKER,W.FRIEDRICHSEN
Literature Reference Citation J.CHEM.SOC.PERKIN-1,59(1999)
Literature Reference DOI 10.1039/a806916f
Molecular Weight 373.449 g/mol
Solvent CDCl3
Source File Reference UWRU9056