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3-(3,4-dimethoxyphenyl)-8-methoxyisocoumarin
SpectraBase Compound ID LWFaBuHYwgg
InChI InChI=1S/C18H16O5/c1-20-13-8-7-11(9-16(13)22-3)15-10-12-5-4-6-14(21-2)17(12)18(19)23-15/h4-10H,1-3H3
InChIKey GHTACAVDDFVAHW-UHFFFAOYSA-N
Mol Weight 312.32 g/mol
Molecular Formula C18H16O5
Exact Mass 312.099774 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IYLQL9acK4N
Name 3-(3,4-dimethoxyphenyl)-8-methoxyisocoumarin
Comments Less than 3 mono-isotopic peaks
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Formula C18H16O5
InChI InChI=1S/C18H16O5/c1-20-13-8-7-11(9-16(13)22-3)15-10-12-5-4-6-14(21-2)17(12)18(19)23-15/h4-10H,1-3H3
InChIKey GHTACAVDDFVAHW-UHFFFAOYSA-N
Molecular Weight 312.321 g/mol
SMILES C1(c2c(cccc2OC)C=C(O1)c1cc(OC)c(cc1)OC)=O
SPLASH splash10-03di-0039000000-3e940e7df5f006a37ecd
Source of Spectrum E1-42-2228-1
Synonyms Thunberginol A trimethyl ether[3-(3,4-Dimethoxyphenyl)-8-methoxyisocoumarin ] Thunberginol A trimethyl ether 3-(3,4-dimethoxyphenyl)-8-methoxy-2-benzopyran-1-one 3-(3,4-dimethoxyphenyl)-8-methoxyisochromen-1-one 3-(3,4-dimethoxyphenyl)-8-methoxy-isochromen-1-one
Wiley ID 1552812