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BrASILIQUINONE-C
SpectraBase Compound ID 35rMyptF5pb
InChI InChI=1S/C21H18O5/c1-3-10-7-11-9-14(23)18-19(16(11)13(22)8-10)20(24)12-5-4-6-15(26-2)17(12)21(18)25/h4-6,9-10,23H,3,7-8H2,1-2H3/t10-/m0/s1
InChIKey JCMDNBJXOUWFMR-JTQLQIEISA-N
Mol Weight 350.37 g/mol
Molecular Formula C21H18O5
Exact Mass 350.115424 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID F7gtBP4Eqoy
Name BrASILIQUINONE-C
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H18O5
InChI InChI=1S/C21H18O5/c1-3-10-7-11-9-14(23)18-19(16(11)13(22)8-10)20(24)12-5-4-6-15(26-2)17(12)21(18)25/h4-6,9-10,23H,3,7-8H2,1-2H3/t10-/m0/s1
InChIKey JCMDNBJXOUWFMR-JTQLQIEISA-N
Literature Reference Author M.TSUDA,H.SATO,Y.TANAKA,K.YAZAWA,Y.MIKAMI,T.SASAKI,J.KOBAYAS HI
Literature Reference Citation J.CHEM.SOC.PERKIN-1,1773(1996)
Literature Reference DOI 10.1039/p19960001773
Molecular Weight 350.371 g/mol
Solvent CDCl3
Source File Reference WANG2056