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Tetrahydropalmatine methyl iodide
SpectraBase Compound ID EYJ8Cj50fTO
InChI InChI=1S/C22H28NO4.HI/c1-23-9-8-15-11-20(25-3)21(26-4)12-16(15)18(23)10-14-6-7-19(24-2)22(27-5)17(14)13-23;/h6-7,11-12,18H,8-10,13H2,1-5H3;1H/q+1;/p-1/t18-,23?;/m0./s1
InChIKey MRAZQMCJIZAGBQ-UYUZYXPGSA-M
Mol Weight 497.37 g/mol
Molecular Formula C22H28INO4
Exact Mass 497.106303 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Erjf1WCSzic
Name Tetrahydropalmatine methyl iodide
Alternate Name(s) (13aS)-2,3,9,10-tetramethoxy-7-methyl-5,8,13,13a-tetrahydro-6H-isoquino[3,2-a]isoquinolinium iodide (13aS)-2,3,9,10-tetramethoxy-7-methyl-6,8,13,13a-tetrahydro-5H-isoquinolino[2,1-b]isoquinolin-7-ium;iodide
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Formula C22H28INO4
InChI InChI=1S/C22H28NO4.HI/c1-23-9-8-15-11-20(25-3)21(26-4)12-16(15)18(23)10-14-6-7-19(24-2)22(27-5)17(14)13-23;/h6-7,11-12,18H,8-10,13H2,1-5H3;1H/q+1;/p-1/t18-,23?;/m0./s1
InChIKey MRAZQMCJIZAGBQ-UYUZYXPGSA-M
Molecular Weight 497.373 g/mol
SMILES [I-].[C@@]12([N+](CCc3c2cc(c(c3)OC)OC)(Cc2c(C1)ccc(c2OC)OC)C)[H]
SPLASH splash10-052f-0914000000-6a2abc079b6186d358ae
Source of Spectrum O-19-607-8
Wiley ID 1398380