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11-methoxy-3,3-dimethyl-8-oxidanyl-2,4-dihydrobenzo[a]anthracene-1,7,12-trione
SpectraBase Compound ID Km27CMYXUE6
InChI InChI=1S/C21H18O5/c1-21(2)8-10-4-5-11-16(15(10)13(23)9-21)20(25)18-14(26-3)7-6-12(22)17(18)19(11)24/h4-7,22H,8-9H2,1-3H3
InChIKey OLPXBNGLEMJWBZ-UHFFFAOYSA-N
Mol Weight 350.37 g/mol
Molecular Formula C21H18O5
Exact Mass 350.115424 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7UDZtS5hZxs
Name 11-methoxy-3,3-dimethyl-8-oxidanyl-2,4-dihydrobenzo[a]anthracene-1,7,12-trione
Alternate Name(s) 8-hydroxy-11-methoxy-3,3-dimethyl-2,4-dihydrobenzo[a]anthracene-1,7,12-trione 8-hydroxy-11-methoxy-3,3-dimethyl-2,4-dihydrobenz[a]anthracene-1,7,12-trione
Comments Less than 3 mono-isotopic peaks
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Formula C21H18O5
InChI InChI=1S/C21H18O5/c1-21(2)8-10-4-5-11-16(15(10)13(23)9-21)20(25)18-14(26-3)7-6-12(22)17(18)19(11)24/h4-7,22H,8-9H2,1-3H3
InChIKey OLPXBNGLEMJWBZ-UHFFFAOYSA-N
Molecular Weight 350.370 g/mol
SMILES Oc1c2c(C(=O)c3c(C2=O)ccc2CC(C)(C)CC(c32)=O)c(OC)cc1
SPLASH splash10-0f6x-0096000000-dc3a4312828516dab478
Source of Spectrum B-51-521-6
Wiley ID 746067