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Magnoflorin iodide
SpectraBase Compound ID Fb48fLSwY0n
InChI InChI=1S/C20H23NO4.HI/c1-21(2)8-7-12-10-15(25-4)20(23)18-16(12)13(21)9-11-5-6-14(24-3)19(22)17(11)18;/h5-6,10,13H,7-9H2,1-4H3,(H-,22,23);1H/t13-;/m0./s1
InChIKey ODRHNGNRVVELAJ-ZOWNYOTGSA-N
Mol Weight 469.31947 g/mol
Molecular Formula C20H24INO4
Exact Mass 469.075003 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4dqPkiqIcEv
Name Magnoflorin iodide
Alternate Name(s) (S)-1,11-dihydroxy-2,10-dimethoxy-6,6-dimethyl-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinolin-6-ium iodide
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Formula C20H24INO4
InChI InChI=1S/C20H23NO4.HI/c1-21(2)8-7-12-10-15(25-4)20(23)18-16(12)13(21)9-11-5-6-14(24-3)19(22)17(11)18;/h5-6,10,13H,7-9H2,1-4H3,(H-,22,23);1H/t13-;/m0./s1
InChIKey ODRHNGNRVVELAJ-ZOWNYOTGSA-N
Literature Reference DOI 10.1002/ardp.19813140311
Molecular Weight 469.319 g/mol
SMILES Oc1c(cc2CC[N+]([C@]3(Cc4ccc(c(c4-c1c23)O)OC)[H])(C)C)OC.[I-]
SPLASH splash10-0a6r-9700000000-4835a07d243d84ecaed3
Source of Spectrum APC-314-255-1
Wiley ID 1787920