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RAC-(4BR,6R,6AS,10AR,10BR)-METHYL-10A-HYDROXY-4B,5,6,6A,7,8,9,10,10A,10B-DECAHYDROBENZO-[A]-PHENANTHREN-6-CARBOXYLATE
SpectraBase Compound ID CCmnWWsF0sw
InChI InChI=1S/C20H24O3/c1-23-19(21)16-12-15-14-7-3-2-6-13(14)9-10-18(15)20(22)11-5-4-8-17(16)20/h2-3,6-7,9-10,15-18,22H,4-5,8,11-12H2,1H3/t15-,16+,17-,18+,20+/m0/s1
InChIKey VSEQQWKKHOXSKO-NMDDUFOESA-N
Mol Weight 312.41 g/mol
Molecular Formula C20H24O3
Exact Mass 312.172545 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4ecIwZaE0iQ
Name RAC-(4BR,6R,6AS,10AR,10BR)-METHYL-10A-HYDROXY-4B,5,6,6A,7,8,9,10,10A,10B-DECAHYDROBENZO-[A]-PHENANTHREN-6-CARBOXYLATE
Compound Number 34
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H24O3
InChI InChI=1S/C20H24O3/c1-23-19(21)16-12-15-14-7-3-2-6-13(14)9-10-18(15)20(22)11-5-4-8-17(16)20/h2-3,6-7,9-10,15-18,22H,4-5,8,11-12H2,1H3/t15-,16+,17-,18+,20+/m0/s1
InChIKey VSEQQWKKHOXSKO-NMDDUFOESA-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 312.409 g/mol
Sample ID 50257
Solvent CDCl3