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OPHIOPOGONANONE-C;5,7-DIHYDROXY-6-METHYL-8-ALDEHYDO-3-(3',4'-METHYLENEDIOXYBENZYL)-CHROMAN-4-ONE
SpectraBase Compound ID CKnVCv0yFZq
InChI InChI=1S/C19H16O7/c1-9-16(21)12(6-20)19-15(17(9)22)18(23)11(7-24-19)4-10-2-3-13-14(5-10)26-8-25-13/h2-3,5-6,11,21-22H,4,7-8H2,1H3
InChIKey AQUXTCZWTTUERG-UHFFFAOYSA-N
Mol Weight 356.33 g/mol
Molecular Formula C19H16O7
Exact Mass 356.089603 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HuamBC3GqM4
Name 5,7-dihydroxy-6-methyl-8-aldehydo-3-(3',4'-methylenedioxybenzyl)chroman-4-one
Appearance Colorless needles
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Formula C19H16O7
InChI InChI=1S/C19H16O7/c1-9-16(21)12(6-20)19-15(17(9)22)18(23)11(7-24-19)4-10-2-3-13-14(5-10)26-8-25-13/h2-3,5-6,11,21-22H,4,7-8H2,1H3
InChIKey AQUXTCZWTTUERG-UHFFFAOYSA-N
Instrument Name Finnigan MAT GCQ
Ionization Type EI
Literature Reference DOI 10.1021/np020204o
Molecular Weight 356.330 g/mol
Reported Formula C19H16O7
SMILES Oc1c2c(c(c(c1C)O)C=O)OCC(C2=O)Cc1ccc2c(c1)OCO2
SPLASH splash10-0a4r-0709000000-e83885f7ed5a590930be
Source of Spectrum G4-65-1733-1
Synonyms Ophiopogonanone C
Wiley ID 1883490