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5-methoxy-3,6-di(p-methoxyphenyl)-1,4-benzoquinon-2-yl acetate
SpectraBase Compound ID 7Qt1ZHDYeyC
InChI InChI=1S/C23H20O7/c1-13(24)30-23-19(15-7-11-17(28-3)12-8-15)20(25)22(29-4)18(21(23)26)14-5-9-16(27-2)10-6-14/h5-12H,1-4H3
InChIKey OBMZCUKRFLTTBM-UHFFFAOYSA-N
Mol Weight 408.41 g/mol
Molecular Formula C23H20O7
Exact Mass 408.120903 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID E9ndEmcoRVG
Name 5-methoxy-3,6-di(p-methoxyphenyl)-1,4-benzoquinon-2-yl acetate
Alternate Name(s) 4-methoxy-2,5-bis(4-methoxyphenyl)-3,6-dioxo-1,4-cyclohexadien-1-yl acetate
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H20O7
InChI InChI=1S/C23H20O7/c1-13(24)30-23-19(15-7-11-17(28-3)12-8-15)20(25)22(29-4)18(21(23)26)14-5-9-16(27-2)10-6-14/h5-12H,1-4H3
InChIKey OBMZCUKRFLTTBM-UHFFFAOYSA-N
Molecular Weight 408.406 g/mol
SMILES C1(=C(C(=O)C(=C(C1=O)c1ccc(cc1)OC)OC)c1ccc(cc1)OC)OC(=O)C
SPLASH splash10-014i-0009100000-49f2e80416f7ee53b190
Source of Spectrum JA-49-1247-0
Wiley ID 1372961