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(1-S,4A-R,5-S,8A-R)-5-[2'-(9'',10''-DIOXO-9'',10''-DIHYDROANTHRACEN-2''-YL)-ETHYL]-1,4A-DIMETHYL-6-METHYLENE-DECAHYDRONAPHTHALEN-1-YLMETHYL-ACETATE

View entire compound with spectra: 1 NMR

(1-S,4A-R,5-S,8A-R)-5-[2'-(9'',10''-DIOXO-9'',10''-DIHYDROANTHRACEN-2''-YL)-ETHYL]-1,4A-DIMETHYL-6-METHYLENE-DECAHYDRONAPHTHALEN-1-YLMETHYL-ACETATE
SpectraBase Compound ID LrH4UHOabcZ
InChI InChI=1S/C32H36O4/c1-20-10-15-28-31(3,19-36-21(2)33)16-7-17-32(28,4)27(20)14-12-22-11-13-25-26(18-22)30(35)24-9-6-5-8-23(24)29(25)34/h5-6,8-9,11,13,18,27-28H,1,7,10,12,14-17,19H2,2-4H3/t27-,28-,31+,32+/m0/s1
InChIKey GTWZFPYKXYRJIW-DSOCELCXSA-N
Mol Weight 484.6 g/mol
Molecular Formula C32H36O4
Exact Mass 484.26136 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LDnaFqmJ5dV
Name (1-S,4A-R,5-S,8A-R)-5-[2'-(9'',10''-DIOXO-9'',10''-DIHYDROANTHRACEN-2''-YL)-ETHYL]-1,4A-DIMETHYL-6-METHYLENE-DECAHYDRONAPHTHALEN-1-YLMETHYL-ACETATE
Compound Number 6E
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C32H36O4
InChI InChI=1S/C32H36O4/c1-20-10-15-28-31(3,19-36-21(2)33)16-7-17-32(28,4)27(20)14-12-22-11-13-25-26(18-22)30(35)24-9-6-5-8-23(24)29(25)34/h5-6,8-9,11,13,18,27-28H,1,7,10,12,14-17,19H2,2-4H3/t27-,28-,31+,32+/m0/s1
InChIKey GTWZFPYKXYRJIW-DSOCELCXSA-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 484.635 g/mol
Sample ID 44491
Solvent CDCl3