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Thunberginol B [3-(3,4-dihydroxyphnyl)-6,8-dihydroxyisocoumarin]
SpectraBase Compound ID 4tVXE4efnPd
InChI InChI=1S/C15H10O6/c16-9-3-8-5-13(7-1-2-10(17)11(18)4-7)21-15(20)14(8)12(19)6-9/h1-6,16-19H
InChIKey NHFGEHLUROYMEB-UHFFFAOYSA-N
Mol Weight 286.24 g/mol
Molecular Formula C15H10O6
Exact Mass 286.047738 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1PADrGhkNj1
Name 3-(3',4'-Dihydroxyphenyl)-6,8-dihydroxyisocoumarin
Alternate Name(s) Thunberginol B
Appearance Pale yellow solid
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Formula C15H10O6
InChI InChI=1S/C15H10O6/c16-9-3-8-5-13(7-1-2-10(17)11(18)4-7)21-15(20)14(8)12(19)6-9/h1-6,16-19H
InChIKey NHFGEHLUROYMEB-UHFFFAOYSA-N
Instrument Name Waters ZQ 2000
Ionization Type EI
Literature Reference DOI 10.3998/ark.5550190.0008.e02
Molecular Weight 286.239 g/mol
SMILES Oc1cc(C=2OC(c3c(cc(cc3C2)O)O)=O)ccc1O
SPLASH splash10-0550-0980000000-fb9e096f4b649fc4597b
Source of Spectrum ARK-2007-18-10
Wiley ID 1868875