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1,4-Ethano-5-hydroxy-1,4-dihydro-9,10-anthraquinone
SpectraBase Compound ID ClNxkdQV1j5
InChI InChI=1S/C16H12O3/c17-11-3-1-2-10-14(11)16(19)13-9-6-4-8(5-7-9)12(13)15(10)18/h1-4,6,8-9,17H,5,7H2
InChIKey PNEYUXMYBRUGJB-UHFFFAOYSA-N
Mol Weight 252.27 g/mol
Molecular Formula C16H12O3
Exact Mass 252.078644 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JHghs7pPZJp
Name 1,4-Ethano-5-hydroxy-1,4-dihydro-9,10-anthraquinone
Alternate Name(s) 5-Hydroxytetracyclo[10.2.2.0(2,11).0(4,9)]hexadeca-2(11),4,6,8,13-pentaene-3,10-dione
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Formula C16H12O3
InChI InChI=1S/C16H12O3/c17-11-3-1-2-10-14(11)16(19)13-9-6-4-8(5-7-9)12(13)15(10)18/h1-4,6,8-9,17H,5,7H2
InChIKey PNEYUXMYBRUGJB-UHFFFAOYSA-N
Molecular Weight 252.269 g/mol
SMILES Oc1c2c(C(C3=C(C2=O)C2CCC3C=C2)=O)ccc1
SPLASH splash10-00di-0490000000-fdb4ddbee5bc8155df7d
Source of Spectrum J-57-6875-20
Wiley ID 1256046