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MARYLAURENCINOL_B;1,3,5-TRIHYDROXY-2,4-DIMETHOXY-9,10-DIHYDROPHENANTHRENE
SpectraBase Compound ID 9SZq6OwAqLh
InChI InChI=1S/C16H16O5/c1-20-15-12-9(13(18)16(21-2)14(15)19)7-6-8-4-3-5-10(17)11(8)12/h3-5,17-19H,6-7H2,1-2H3
InChIKey GIGHDDGEYQHXGI-UHFFFAOYSA-N
Mol Weight 288.3 g/mol
Molecular Formula C16H16O5
Exact Mass 288.099774 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 81xWdFsmo4n
Name 1,3,5-trihydroxy-2,4-dimethoxy-9,10-dihydrophenanthrene
Appearance Brown needles
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Formula C16H16O5
InChI InChI=1S/C16H16O5/c1-20-15-12-9(13(18)16(21-2)14(15)19)7-6-8-4-3-5-10(17)11(8)12/h3-5,17-19H,6-7H2,1-2H3
InChIKey GIGHDDGEYQHXGI-UHFFFAOYSA-N
Instrument Name JEOL JMS-700
Ionization Type EI
Literature Reference DOI 10.1021/np200788u
Molecular Weight 288.299 g/mol
Reported Formula C16H16O5
SMILES Oc1cccc2CCc3c(c(c(c(c3-c12)OC)O)OC)O
SPLASH splash10-0079-0090000000-949608d16cd4e8f4d632
Source of Spectrum G4-75-608-3
Synonyms Marylaurencinol B
Wiley ID 1854775