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(R)-[Methoxy-13C]Torosachrysone
SpectraBase Compound ID 2aSTbVCJhw3
InChI InChI=1S/C16H16O5/c1-16(20)6-9-3-8-4-10(21-2)5-11(17)13(8)15(19)14(9)12(18)7-16/h3-5,17,19-20H,6-7H2,1-2H3/t16-/m1/s1/i2+1
InChIKey BFMIUBHJKFRWIV-AWWHSFCOSA-N
Mol Weight 289.29 g/mol
Molecular Formula C1513CH16O5
Exact Mass 289.103128 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID K8qgA9hP881
Name (R)-[Methoxy-13C]Torosachrysone
Alternate Name(s) (3R)-6-methoxy-3-methyl-3,8,9-tris(oxidanyl)-2,4-dihydroanthracen-1-one
Comments Original formula: C15[13C]H16O5
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Formula C16H16O5
InChI InChI=1S/C16H16O5/c1-16(20)6-9-3-8-4-10(21-2)5-11(17)13(8)15(19)14(9)12(18)7-16/h3-5,17,19-20H,6-7H2,1-2H3/t16-/m1/s1/i2+1
InChIKey BFMIUBHJKFRWIV-AWWHSFCOSA-N
Molecular Weight 289.291 g/mol
SMILES O[C@]1(CC(c2c(c3c(cc(cc3cc2C1)O[13CH3])O)O)=O)C
SPLASH splash10-000i-0090000000-ab07784d7561279f3c9b
Source of Spectrum KC-0-2488-2
Wiley ID 831329