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5-(3,4-Dihydroxyphenyl)-6,7-dimethyl-5,6,7,8-tetrahydronaphthalene-2,3-diol, 4ac derivative
SpectraBase Compound ID 8tLhnJzH7fC
InChI InChI=1S/C26H28O8/c1-13-9-20-11-24(33-17(5)29)25(34-18(6)30)12-21(20)26(14(13)2)19-7-8-22(31-15(3)27)23(10-19)32-16(4)28/h7-8,10-14,26H,9H2,1-6H3
InChIKey VOAJUMGWOWLNFV-UHFFFAOYSA-N
Mol Weight 468.5 g/mol
Molecular Formula C26H28O8
Exact Mass 468.178418 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BQGvmLrlzlx
Name 5-(3,4-Dihydroxyphenyl)-6,7-dimethyl-5,6,7,8-tetrahydronaphthalene-2,3-diol, 4ac derivative
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 468.178417854 u
Formula C26H28O8
InChI InChI=1S/C26H28O8/c1-13-9-20-11-24(33-17(5)29)25(34-18(6)30)12-21(20)26(14(13)2)19-7-8-22(31-15(3)27)23(10-19)32-16(4)28/h7-8,10-14,26H,9H2,1-6H3
InChIKey VOAJUMGWOWLNFV-UHFFFAOYSA-N
Molecular Weight 468.502 g/mol
SMILES CC(=O)OC1=CC(=CC=C1OC(C)=O)C1C(C)C(C)CC2=C1C=C(OC(C)=O)C(OC(C)=O)=C2