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2-(3-acetyl-4-hydroxy-9,10-diketo-2-anthryl)acetic acid tert-butyl ester
SpectraBase Compound ID Az75WEHrzSQ
InChI InChI=1S/C22H20O6/c1-11(23)17-12(10-16(24)28-22(2,3)4)9-15-18(21(17)27)20(26)14-8-6-5-7-13(14)19(15)25/h5-9,27H,10H2,1-4H3
InChIKey HONIDDJXXHVKEK-UHFFFAOYSA-N
Mol Weight 380.4 g/mol
Molecular Formula C22H20O6
Exact Mass 380.125988 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID He9PElEOakg
Name 2-(3-acetyl-4-hydroxy-9,10-diketo-2-anthryl)acetic acid tert-butyl ester
Alternate Name(s) 2-(3-acetyl-4-hydroxy-9,10-dioxo-2-anthracenyl)acetic acid tert-butyl ester tert-Butyl 2-(3-acetyl-4-hydroxy-9,10-dioxo-2-anthryl)acetate tert-Butyl 2-(3-acetyl-4-hydroxy-9,10-dioxoanthracen-2-yl)acetate tert-Butyl 2-[3-ethanoyl-4-oxidanyl-9,10-bis(oxidanylidene)anthracen-2-yl]ethanoate
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Formula C22H20O6
InChI InChI=1S/C22H20O6/c1-11(23)17-12(10-16(24)28-22(2,3)4)9-15-18(21(17)27)20(26)14-8-6-5-7-13(14)19(15)25/h5-9,27H,10H2,1-4H3
InChIKey HONIDDJXXHVKEK-UHFFFAOYSA-N
Molecular Weight 380.396 g/mol
SMILES Oc1c2c(C(=O)c3c(C2=O)cccc3)cc(c1C(=O)C)CC(OC(C)(C)C)=O
SPLASH splash10-0629-4097000000-cb49953ec081d2bcdfd6
Source of Spectrum U-1996-273-11
Wiley ID 768226