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CORDIAQUINONE-L;6-[10-(12,12-DIMETHYL-13-ALPHA-HYDROXY-16-METHENYL-CYCLOHEXYL)-ETHYL]-1,4-NAPHTHALENEDIONE
SpectraBase Compound ID gAtPKLDGkZ
InChI InChI=1S/C21H24O3/c1-13-4-11-20(24)21(2,3)17(13)8-6-14-5-7-15-16(12-14)19(23)10-9-18(15)22/h5,7,9-10,12,17,20,24H,1,4,6,8,11H2,2-3H3/t17-,20+/m1/s1
InChIKey JKCAGNYZQGYYHD-XLIONFOSSA-N
Mol Weight 324.42 g/mol
Molecular Formula C21H24O3
Exact Mass 324.172545 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CXYlggoTZ1b
Name CORDIAQUINONE-L;6-[10-(12,12-DIMETHYL-13-ALPHA-HYDROXY-16-METHENYL-CYCLOHEXYL)-ETHYL]-1,4-NAPHTHALENEDIONE
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H24O3
InChI InChI=1S/C21H24O3/c1-13-4-11-20(24)21(2,3)17(13)8-6-14-5-7-15-16(12-14)19(23)10-9-18(15)22/h5,7,9-10,12,17,20,24H,1,4,6,8,11H2,2-3H3/t17-,20+/m1/s1
InChIKey JKCAGNYZQGYYHD-XLIONFOSSA-N
Literature Reference Author J.C.DINIZ,F.A.VIANA,O.F.OLIVEIRA,M.A.M.MACIEL,A.D.C.D.M.TORR ES,R.BRAZ-FILHO,E.R.
Literature Reference Citation MAGN.RES.CHEM.,47,190(2009)
Literature Reference DOI 10.1002/mrc.2373
Molecular Weight 324.420 g/mol
Solvent CDCl3
Source File Reference UWLU79512