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Sanguinarine
SpectraBase Compound ID BwxACV1vS72
InChI InChI=1S/C20H14NO4/c1-21-8-11-6-17-18(24-9-23-17)7-15(11)13-2-3-14-12(19(13)21)4-5-16-20(14)25-10-22-16/h2-8H,9-10H2,1H3/q+1
InChIKey OBJWDJCRVXBCHP-UHFFFAOYSA-N
Mol Weight 332.34 g/mol
Molecular Formula C20H14NO4
Exact Mass 332.092283 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FPC2djkMV9q
Name Sanguinarine
Alternate Name(s) 6-Methyl-[1,3]dioxolo[4',5':5,6]benzo[1,2-c][1,3]dioxolo[4,5-j]phenanthridin-6-ium
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Formula C20H14NO4
InChI InChI=1S/C20H14NO4/c1-21-8-11-6-17-18(24-9-23-17)7-15(11)13-2-3-14-12(19(13)21)4-5-16-20(14)25-10-22-16/h2-8H,9-10H2,1H3/q+1
InChIKey OBJWDJCRVXBCHP-UHFFFAOYSA-N
Molecular Weight 332.335 g/mol
SMILES c1c2c(cc3c4c([n+](cc13)C)c1c(c3c(cc1)OCO3)cc4)OCO2
SPLASH splash10-014i-0039000000-5412d22551d35dc84db8
Source of Spectrum PA-13-178-1
Wiley ID 1789440