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Chabrolobenzoquinone C
SpectraBase Compound ID JexyQvOFEZl
InChI InChI=1S/C27H36O4/c1-19(2)9-6-13-23(27(30)31)14-8-12-20(3)10-7-11-21(4)15-16-24-18-25(28)22(5)17-26(24)29/h9-10,14-15,17-18H,6-8,11-13,16H2,1-5H3,(H,30,31)/b20-10+,21-15+,23-14-
InChIKey MMLRYQXCAKDHJW-FWXQPYBBSA-N
Mol Weight 424.6 g/mol
Molecular Formula C27H36O4
Exact Mass 424.26136 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Vr5iSc5dP5
Name CHABROLOBENZOQUINONE-C
Compound Number 8
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H36O4
InChI InChI=1S/C27H36O4/c1-19(2)9-6-13-23(27(30)31)14-8-12-20(3)10-7-11-21(4)15-16-24-18-25(28)22(5)17-26(24)29/h9-10,14-15,17-18H,6-8,11-13,16H2,1-5H3,(H,30,31)/b20-10+,21-15+,23-14-
InChIKey MMLRYQXCAKDHJW-FWXQPYBBSA-N
Literature Reference Author J.H.SHEU,J.H.SU,P.J.SUNG,G.H.WANG,C.F.DAI
Literature Reference Citation J.NAT.PROD.,67,2048(2004)
Literature Reference DOI 10.1021/np0401314
Molecular Weight 424.580 g/mol
Solvent CDCl3
Source File Reference UWMZ6852