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CORDIAQUINONE-B;6-[10-(11,12,16-TRIMETHYL-13-OXOCYClOHEXYL)-ETHYL]-1,4-NAPHTHALENEDIONE
SpectraBase Compound ID 18833Wk72ro
InChI InChI=1S/C21H24O3/c1-13-4-7-18(22)14(2)21(13,3)11-10-15-5-6-16-17(12-15)20(24)9-8-19(16)23/h5-6,8-9,12-14H,4,7,10-11H2,1-3H3/t13-,14+,21-/m0/s1
InChIKey MASRYVQKFOORHS-QTCYRWPVSA-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 EQ8TlcCdT7V
Name CORDIAQUINONE-B;6-[10-(11,12,16-TRIMETHYL-13-OXOCYClOHEXYL)-ETHYL]-1,4-NAPHTHALENEDIONE
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H24O3
InChI InChI=1S/C21H24O3/c1-13-4-7-18(22)14(2)21(13,3)11-10-15-5-6-16-17(12-15)20(24)9-8-19(16)23/h5-6,8-9,12-14H,4,7,10-11H2,1-3H3/t13-,14+,21-/m0/s1
InChIKey MASRYVQKFOORHS-QTCYRWPVSA-N
Literature Reference Author J.R.IOSET,A.MARSTON,M.P.GUPTA,K.HOSTETTMANN
Literature Reference Citation PHYTOCHEM.,47,729(1998)
Literature Reference DOI 10.1016/S0031-9422(97)00695-X
Molecular Weight 324.420 g/mol
Solvent CDCl3
Source File Reference UWMS225