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t-Butyl Ethyl 2-3'-(1'',5"-dimethoxy-9",10'-dioxo-9",10"-dihydroanrhracen-2''-yl)-2'-methylpropionyl]malonate
SpectraBase Compound ID GTaydJVoMMV
InChI InChI=1S/C29H32O9/c1-8-37-27(33)22(28(34)38-29(3,4)5)23(30)15(2)14-16-12-13-18-21(26(16)36-7)25(32)17-10-9-11-19(35-6)20(17)24(18)31/h9-13,15,22H,8,14H2,1-7H3
InChIKey ZQKXWQGXCRHCJF-UHFFFAOYSA-N
Mol Weight 524.6 g/mol
Molecular Formula C29H32O9
Exact Mass 524.204633 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 58IMhoXEH1n
Name t-Butyl Ethyl 2-3'-(1'',5"-dimethoxy-9",10'-dioxo-9",10"-dihydroanrhracen-2''-yl)-2'-methylpropionyl]malonate
Alternate Name(s) (t-Butyl) Ethyl 2-{3'-[(1'',5''-dimethoxy-9'',10''-dioxo-9'',10''-dihydroanthracen-2''-yl)-2'-methylpropionyl]}-malonate 1-tert-Butyl 3-ethyl 2-[2-(1,5-dimethoxy-9,10-dioxo-9,10-dihydro-2-anthracenyl)-2-methylpropanoyl]malonate t-Butyl Ethyl 2-{3'-(1'',5''-dimethoxy-9'',10'-dioxo-9'',10''-dihydroanrhracen-2''-yl)-2'-methylpropionyl]malonate
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Formula C29H32O9
InChI InChI=1S/C29H32O9/c1-8-37-27(33)22(28(34)38-29(3,4)5)23(30)15(2)14-16-12-13-18-21(26(16)36-7)25(32)17-10-9-11-19(35-6)20(17)24(18)31/h9-13,15,22H,8,14H2,1-7H3
InChIKey ZQKXWQGXCRHCJF-UHFFFAOYSA-N
Molecular Weight 524.566 g/mol
SMILES c12C(c3cccc(c3C(c2ccc(c1OC)CC(C(C(C(OC(C)(C)C)=O)C(=O)OCC)=O)C)=O)OC)=O
SPLASH splash10-0a4i-0009100000-8008d33a68c3b0c08237
Source of Spectrum Y4-91-391-6
Wiley ID 1550545