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RAC-(3AS,3BR,9BR,11S,11AS)-METHYL-3A-HYDROXY-2,3,3A,3B,9B,10,11,11A-OCTAHYDRO-1H-CYCLOPENTA-[A]-PHENANTHREN-11-CARBOXYLATE

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RAC-(3AS,3BR,9BR,11S,11AS)-METHYL-3A-HYDROXY-2,3,3A,3B,9B,10,11,11A-OCTAHYDRO-1H-CYCLOPENTA-[A]-PHENANTHREN-11-CARBOXYLATE
SpectraBase Compound ID EapukEB0GUO
InChI InChI=1S/C19H22O3/c1-22-18(20)15-11-14-13-6-3-2-5-12(13)8-9-17(14)19(21)10-4-7-16(15)19/h2-3,5-6,8-9,14-17,21H,4,7,10-11H2,1H3/t14-,15-,16-,17+,19+/m0/s1
InChIKey FKTDNFGKYHFQQE-YTGMWSOZSA-N
Mol Weight 298.38 g/mol
Molecular Formula C19H22O3
Exact Mass 298.156895 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 737O7fWAydY
Name RAC-(3AS,3BR,9BR,11S,11AS)-METHYL-3A-HYDROXY-2,3,3A,3B,9B,10,11,11A-OCTAHYDRO-1H-CYCLOPENTA-[A]-PHENANTHREN-11-CARBOXYLATE
Compound Number 30
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C19H22O3
InChI InChI=1S/C19H22O3/c1-22-18(20)15-11-14-13-6-3-2-5-12(13)8-9-17(14)19(21)10-4-7-16(15)19/h2-3,5-6,8-9,14-17,21H,4,7,10-11H2,1H3/t14-,15-,16-,17+,19+/m0/s1
InChIKey FKTDNFGKYHFQQE-YTGMWSOZSA-N
Literature Reference Author M.BERNDT,I.HLOBILOVA,H.U.REISSIG
Literature Reference Citation ORG.LETTERS,6,957(2004)
Literature Reference DOI 10.1021/ol036456d
Molecular Weight 298.382 g/mol
Sample ID 50255
Solvent CDCl3