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(4,5-dihydroxy-9,10-dioxo-2-anthryl)methyl 2,2-dimethylpropanoate
SpectraBase Compound ID IbtuSAAYjmL
InChI InChI=1S/C20H18O6/c1-20(2,3)19(25)26-9-10-7-12-16(14(22)8-10)18(24)15-11(17(12)23)5-4-6-13(15)21/h4-8,21-22H,9H2,1-3H3
InChIKey WPIPGSLEBDQIPE-UHFFFAOYSA-N
Mol Weight 354.36 g/mol
Molecular Formula C20H18O6
Exact Mass 354.110338 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 340btk9z8a
Name (4,5-dihydroxy-9,10-dioxo-2-anthryl)methyl 2,2-dimethylpropanoate
Alternate Name(s) (4,5-dihydroxy-9,10-dioxoanthracen-2-yl)methyl 2,2-dimethylpropanoate 2,2-Dimethylpropanoic acid (4,5-dihydroxy-9,10-dioxo-2-anthracenyl)methyl ester 2,2-Dimethylpropionic acid (4,5-dihydroxy-9,10-diketo-2-anthryl)methyl ester [4,5-bis(oxidanyl)-9,10-bis(oxidanylidene)anthracen-2-yl]methyl 2,2-dimethylpropanoate
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Formula C20H18O6
InChI InChI=1S/C20H18O6/c1-20(2,3)19(25)26-9-10-7-12-16(14(22)8-10)18(24)15-11(17(12)23)5-4-6-13(15)21/h4-8,21-22H,9H2,1-3H3
InChIKey WPIPGSLEBDQIPE-UHFFFAOYSA-N
Molecular Weight 354.358 g/mol
SMILES Oc1cccc2C(c3cc(cc(c3C(c12)=O)O)COC(C(C)(C)C)=O)=O
SPLASH splash10-0uk9-0093000000-87d60d2a0950f96d0d82
Source of Spectrum K-2001-3196-27
Wiley ID 1580079