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(5aS,6S,11aS)-6-Hydroxy-1,4,4a,5a,6,11,11a,12a-octahydro-naphthacene-5,12-dione
SpectraBase Compound ID J1Vi6PNPxSA
InChI InChI=1S/C18H18O3/c19-16-12-7-3-4-8-13(12)18(21)15-14(16)9-10-5-1-2-6-11(10)17(15)20/h1-6,12-15,17,20H,7-9H2/t12?,13?,14-,15-,17+/m0/s1
InChIKey AUBUWRHRZKXFSS-XRLSCXDPSA-N
Mol Weight 282.34 g/mol
Molecular Formula C18H18O3
Exact Mass 282.125594 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GCrCRh4Sxe5
Name (5aS,6S,11aS)-6-Hydroxy-1,4,4a,5a,6,11,11a,12a-octahydro-naphthacene-5,12-dione
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Formula C18H18O3
InChI InChI=1S/C18H18O3/c19-16-12-7-3-4-8-13(12)18(21)15-14(16)9-10-5-1-2-6-11(10)17(15)20/h1-6,12-15,17,20H,7-9H2/t12?,13?,14-,15-,17+/m0/s1
InChIKey AUBUWRHRZKXFSS-XRLSCXDPSA-N
Molecular Weight 282.339 g/mol
SMILES O[C@]1([C@]2(C(C3CC=CCC3C([C@]2(Cc2c1cccc2)[H])=O)=O)[H])[H]
SPLASH splash10-01t9-1950000000-9c232d11a16c0d9b9826
Source of Spectrum Y4-79-121-7
Synonyms (5aS,6S,11aS)-6-hydroxy-1,4,4a,5a,6,11,11a,12a-octahydro-5,12-naphthacenedione 6-Hydroxy-1,4,4a,5a,6,11,11a,12a-octahydro-5,12-naphthacenequinone
Wiley ID 1513098