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RAC-(4BR,6R,6AS,10AR,10BR)-METHYL-8-ETHYLENEACETAL-10A-HYDROXY-4B,5,6,6A,7,8,9,10,10A,10B-DECAHYDROBENZO-[A]-PHENANTHREN-6-CARBOXYLATE
SpectraBase Compound ID FdyKVfRCnd6
InChI InChI=1S/C22H26O5/c1-25-20(23)17-12-16-15-5-3-2-4-14(15)6-7-18(16)22(24)9-8-21(13-19(17)22)26-10-11-27-21/h2-7,16-19,24H,8-13H2,1H3/t16-,17+,18+,19-,22-/m0/s1
InChIKey LKPHPHQKYJONEF-TZDBLYRBSA-N
Mol Weight 370.45 g/mol
Molecular Formula C22H26O5
Exact Mass 370.178024 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IrWVXqVW8f
Name RAC-(4BR,6R,6AS,10AR,10BR)-METHYL-8-ETHYLENEACETAL-10A-HYDROXY-4B,5,6,6A,7,8,9,10,10A,10B-DECAHYDROBENZO-[A]-PHENANTHREN-6-CARBOXYLATE
Compound Number 37
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H26O5
InChI InChI=1S/C22H26O5/c1-25-20(23)17-12-16-15-5-3-2-4-14(15)6-7-18(16)22(24)9-8-21(13-19(17)22)26-10-11-27-21/h2-7,16-19,24H,8-13H2,1H3/t16-,17+,18+,19-,22-/m0/s1
InChIKey LKPHPHQKYJONEF-TZDBLYRBSA-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 370.445 g/mol
Sample ID 50259
Solvent CDCl3