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4a-Carbomethioxy-4,8-dihydroxy-6-methyl-1,4,4a,9a-tetrahydroxanthone
SpectraBase Compound ID 4h0uAYumbgM
InChI InChI=1S/C16H16O6/c1-8-6-10(17)13-11(7-8)22-16(15(20)21-2)9(14(13)19)4-3-5-12(16)18/h3,5-7,9,12,17-18H,4H2,1-2H3/t9?,12-,16?/m1/s1
InChIKey SQQVLPAZXRNECF-FTMAYTQWSA-N
Mol Weight 304.3 g/mol
Molecular Formula C16H16O6
Exact Mass 304.094688 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DOdYxuriZDI
Name 4a-Carbomethioxy-4,8-dihydroxy-6-methyl-1,4,4a,9a-tetrahydroxanthone
Comments Less than 3 mono-isotopic peaks
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Formula C16H16O6
InChI InChI=1S/C16H16O6/c1-8-6-10(17)13-11(7-8)22-16(15(20)21-2)9(14(13)19)4-3-5-12(16)18/h3,5-7,9,12,17-18H,4H2,1-2H3/t9?,12-,16?/m1/s1
InChIKey SQQVLPAZXRNECF-FTMAYTQWSA-N
Molecular Weight 304.298 g/mol
SMILES Oc1cc(cc2c1C(C1C([C@@](C=CC1)(O)[H])(O2)C(=O)OC)=O)C
SPLASH splash10-004i-0091000000-3b178e5a6651f3d0b003
Source of Spectrum E2-46-1509-5
Wiley ID 1554586