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11-Hydroxy-3,3-dimethyl-7,12-dioxo-1,2,3,4,7,12-hexahydrobenzo[a]anthracen-1-yl acetate
SpectraBase Compound ID HiZdVASmBAb
InChI InChI=1S/C22H20O5/c1-11(23)27-16-10-22(2,3)9-12-7-8-14-19(17(12)16)21(26)18-13(20(14)25)5-4-6-15(18)24/h4-8,16,24H,9-10H2,1-3H3
InChIKey QTNQBXQLAGKTJV-UHFFFAOYSA-N
Mol Weight 364.4 g/mol
Molecular Formula C22H20O5
Exact Mass 364.131074 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID InAZiba4o3w
Name 11-Hydroxy-3,3-dimethyl-7,12-dioxo-1,2,3,4,7,12-hexahydrobenzo[a]anthracen-1-yl acetate
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Formula C22H20O5
InChI InChI=1S/C22H20O5/c1-11(23)27-16-10-22(2,3)9-12-7-8-14-19(17(12)16)21(26)18-13(20(14)25)5-4-6-15(18)24/h4-8,16,24H,9-10H2,1-3H3
InChIKey QTNQBXQLAGKTJV-UHFFFAOYSA-N
Molecular Weight 364.397 g/mol
SMILES Oc1cccc2C(c3ccc4c(c3C(c12)=O)C(OC(C)=O)CC(C4)(C)C)=O
SPLASH splash10-0f79-0098000000-9c3ca745a32e9e0054fa
Source of Spectrum B-52-133-12
Synonyms 3,3-Dimethyl-11-hydroxy-7,12-dioxo-1,2,3,4,7,12-hexahydrobenzo[a]anthracen-1-yl acetate
Wiley ID 746414