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5,8-dihydroxy-2,3,6-trimethoxy-1,4-naphthoquinone
SpectraBase Compound ID 18m3vDfmpMg
InChI InChI=1S/C13H12O7/c1-18-6-4-5(14)7-8(9(6)15)11(17)13(20-3)12(19-2)10(7)16/h4,14-15H,1-3H3
InChIKey BMXJCHIEWJGGAA-UHFFFAOYSA-N
Mol Weight 280.23 g/mol
Molecular Formula C13H12O7
Exact Mass 280.058303 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID K7sUrCKcbxo
Name 5,8-dihydroxy-2,3,6-trimethoxy-1,4-naphthoquinone
Appearance Red-brown needles
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Formula C13H12O7
InChI InChI=1S/C13H12O7/c1-18-6-4-5(14)7-8(9(6)15)11(17)13(20-3)12(19-2)10(7)16/h4,14-15H,1-3H3
InChIKey BMXJCHIEWJGGAA-UHFFFAOYSA-N
Ionization Type EI
Molecular Weight 280.232 g/mol
SMILES Oc1c2C(C(=C(C(c2c(c(c1)OC)O)=O)OC)OC)=O
SPLASH splash10-001i-0090000000-e7ae8449a93e9886c250
Source of Spectrum RU2612265C1
Thin-Layer Chromatography Rf = 0.40 (n-hexane-acetone, 2:1)
Wiley ID 1855316