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(2S*,4R*,4AR*,7AR*,12BR*)-2,4-DIACETYL-8-BENZYL-4A-HYDROXY-1,2,3,4,4A,5,6,7,7A,8-DECAHYDROBENZO-[D]-CARBAZOLE
SpectraBase Compound ID DDpau5AV5JU
InChI InChI=1S/C27H31NO3/c1-18(29)21-15-23(19(2)30)27(31)14-8-13-25-26(27,16-21)22-11-6-7-12-24(22)28(25)17-20-9-4-3-5-10-20/h3-7,9-12,21,23,25,31H,8,13-17H2,1-2H3/t21-,23-,25+,26+,27+/m1/s1
InChIKey FNPGEPZNZILQSC-FJWAISFTSA-N
Mol Weight 417.55 g/mol
Molecular Formula C27H31NO3
Exact Mass 417.230394 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Htw3oZOOEAd
Name (2S*,4R*,4AR*,7AR*,12BR*)-2,4-DIACETYL-8-BENZYL-4A-HYDROXY-1,2,3,4,4A,5,6,7,7A,8-DECAHYDROBENZO-[D]-CARBAZOLE
Compound Number 18
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H31NO3
InChI InChI=1S/C27H31NO3/c1-18(29)21-15-23(19(2)30)27(31)14-8-13-25-26(27,16-21)22-11-6-7-12-24(22)28(25)17-20-9-4-3-5-10-20/h3-7,9-12,21,23,25,31H,8,13-17H2,1-2H3/t21-,23-,25+,26+,27+/m1/s1
InChIKey FNPGEPZNZILQSC-FJWAISFTSA-N
Literature Reference Author D.DUGAT,N.BENCHEKROUN-MOUNIR,G.DAUPHIN,J.C.GRAMAIN
Literature Reference Citation J.CHEM.SOC.PERKIN-1,2145(1998)
Literature Reference DOI 10.1039/a802620c
Molecular Weight 417.548 g/mol
Solvent CDCl3
Source File Reference UWGE3710