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#3C;(1-S,4A-R,5-S,8A-R)-5-[2'-(5'',8''-DIOXO-5'',8''-DIHYDRO-NAPHTHALEN-2''-YL)-ETHYL]-1,4A-DIMETHYL-6-METHYLENE-DECAHYDRONAPHTHALENE-1-CARBOXYLIC-ACID-METHYLESTER

View entire compound with spectra: 1 NMR

#3C;(1-S,4A-R,5-S,8A-R)-5-[2'-(5'',8''-DIOXO-5'',8''-DIHYDRO-NAPHTHALEN-2''-YL)-ETHYL]-1,4A-DIMETHYL-6-METHYLENE-DECAHYDRONAPHTHALENE-1-CARBOXYLIC-ACID-METHYLESTER
SpectraBase Compound ID BTrLjXhJGjH
InChI InChI=1S/C27H32O4/c1-17-6-13-24-26(2,14-5-15-27(24,3)25(30)31-4)21(17)10-8-18-7-9-19-20(16-18)23(29)12-11-22(19)28/h7,9,11-12,16,21,24H,1,5-6,8,10,13-15H2,2-4H3/t21-,24+,26+,27-/m0/s1
InChIKey RVNDPBRBSHYELR-MPYVGDORSA-N
Mol Weight 420.5 g/mol
Molecular Formula C27H32O4
Exact Mass 420.23006 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8rAeWAFFvJn
Name #3C;(1-S,4A-R,5-S,8A-R)-5-[2'-(5'',8''-DIOXO-5'',8''-DIHYDRO-NAPHTHALEN-2''-YL)-ETHYL]-1,4A-DIMETHYL-6-METHYLENE-DECAHYDRONAPHTHALENE-1-CARBOXYLIC-ACID-METHYLESTER
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H32O4
InChI InChI=1S/C27H32O4/c1-17-6-13-24-26(2,14-5-15-27(24,3)25(30)31-4)21(17)10-8-18-7-9-19-20(16-18)23(29)12-11-22(19)28/h7,9,11-12,16,21,24H,1,5-6,8,10,13-15H2,2-4H3/t21-,24+,26+,27-/m0/s1
InChIKey RVNDPBRBSHYELR-MPYVGDORSA-N
Literature Reference Author J.M.M.D.CORRAL,M.GORDALIZA,M.A.CASTRO,M.M.MAHIQUES,P.CHAMORR O,A.MOLINARI,M.D.GAR
Literature Reference Citation J.MED.CHEM.,44,1257(2001)
Literature Reference DOI 10.1021/jm001048q
Molecular Weight 420.549 g/mol
Sample ID 44469
Solvent CDCl3