John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=83mPbXERdCX SpectraBase Spectrum ID=EUMTDxJ8J0M

(accessed ).
CHABROLOHYDROXYBENZOQUINONE_F
SpectraBase Compound ID 83mPbXERdCX
InChI InChI=1S/C27H40O4/c1-19(2)9-7-10-20(3)15-24(28)16-21(4)11-8-13-27(6,31)14-12-23-18-25(29)22(5)17-26(23)30/h9,11-12,14-15,17-18,24,28-31H,7-8,10,13,16H2,1-6H3/b14-12-,20-15+,21-11+
InChIKey UHUUMLHCKBNMSI-NXIFOBCZSA-N
Mol Weight 428.6 g/mol
Molecular Formula C27H40O4
Exact Mass 428.29266 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EUMTDxJ8J0M
Name CHABROLOHYDROXYBENZOQUINONE_F
Compound Number 7
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H40O4
InChI InChI=1S/C27H40O4/c1-19(2)9-7-10-20(3)15-24(28)16-21(4)11-8-13-27(6,31)14-12-23-18-25(29)22(5)17-26(23)30/h9,11-12,14-15,17-18,24,28-31H,7-8,10,13,16H2,1-6H3/b14-12-,20-15+,21-11+
InChIKey UHUUMLHCKBNMSI-NXIFOBCZSA-N
Literature Reference Author J.H.SU,A.F.AHMED,P.J.SUNG,Y.C.WU,J.H.SHEU
Literature Reference Citation J.NAT.PROD.,68,1651(2005)
Literature Reference DOI 10.1021/np050278a
Molecular Weight 428.612 g/mol
Solvent CDCl3
Source File Reference UWMZ13099
SpectraBase Batch ID 4JZGKJWwivy