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2-Acetyloxy-3,6-bis(4'-acetyloxyphenyl)-5-methoxycyclohexa-2,5-diene-1,4-dione
SpectraBase Compound ID Do5d9WCKQBk
InChI InChI=1S/C25H20O9/c1-13(26)32-18-9-5-16(6-10-18)20-23(30)25(34-15(3)28)21(22(29)24(20)31-4)17-7-11-19(12-8-17)33-14(2)27/h5-12H,1-4H3
InChIKey PCJUMEDTLSVRHB-UHFFFAOYSA-N
Mol Weight 464.43 g/mol
Molecular Formula C25H20O9
Exact Mass 464.110732 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2ZgIB4s9jDg
Name 2-Acetyloxy-3,6-bis(4'-acetyloxyphenyl)-5-methoxycyclohexa-2,5-diene-1,4-dione
Alternate Name(s) 4-{2-(acetyloxy)-4-[4-(acetyloxy)phenyl]-5-methoxy-3,6-dioxo-1,4-cyclohexadien-1-yl}phenyl acetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H20O9
InChI InChI=1S/C25H20O9/c1-13(26)32-18-9-5-16(6-10-18)20-23(30)25(34-15(3)28)21(22(29)24(20)31-4)17-7-11-19(12-8-17)33-14(2)27/h5-12H,1-4H3
InChIKey PCJUMEDTLSVRHB-UHFFFAOYSA-N
Molecular Weight 464.426 g/mol
SMILES C1(=C(C(=O)C(=C(C1=O)c1ccc(OC(=O)C)cc1)OC)c1ccc(OC(=O)C)cc1)OC(=O)C
SPLASH splash10-0019-0029300000-3b0098d11e177659f082
Source of Spectrum H-84-3348-1
Wiley ID 847774