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(+)-(S)-Geibalansine methiodide
SpectraBase Compound ID 4LUCAhkFqlz
InChI InChI=1S/C16H20NO3.HI/c1-16(2)13(18)9-11-14(19-4)10-7-5-6-8-12(10)17(3)15(11)20-16;/h5-8,13,18H,9H2,1-4H3;1H/q+1;/p-1/t13-;/m0./s1
InChIKey ORKXZVRWQDFUMO-ZOWNYOTGSA-M
Mol Weight 401.24 g/mol
Molecular Formula C16H20INO3
Exact Mass 401.048789 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 80stizjO9Ps
Name (+)-(S)-Geibalansine methiodide
Alternate Name(s) (3S)-3-hydroxy-5-methoxy-2,2,10-trimethyl-3,4-dihydro-2H-pyrano[2,3-b]quinolin-10-ium iodide (3S)-5-methoxy-2,2,10-trimethyl-3,4-dihydropyrano[2,3-b]quinolin-10-ium-3-ol iodide
Comments Less than 3 mono-isotopic peaks
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Formula C16H20INO3
InChI InChI=1S/C16H20NO3.HI/c1-16(2)13(18)9-11-14(19-4)10-7-5-6-8-12(10)17(3)15(11)20-16;/h5-8,13,18H,9H2,1-4H3;1H/q+1;/p-1/t13-;/m0./s1
InChIKey ORKXZVRWQDFUMO-ZOWNYOTGSA-M
Molecular Weight 401.244 g/mol
SMILES [I-].O[C@@]1(C(Oc2[n+](c3ccccc3c(c2C1)OC)C)(C)C)[H]
SPLASH splash10-0006-0900000000-81c2a99c908a3e03397c
Source of Spectrum KC-0-3404-8
Wiley ID 831780