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O,O'-dimethyl-Magnoflorin iodide
SpectraBase Compound ID LiS7Zdk9rdp
InChI InChI=1S/C22H30NO4.HI/c1-23(2)10-9-16-13-21(26-5)22(27-6)14-17(16)18(23)11-15-7-8-19(24-3)20(12-15)25-4;/h7-8,12-14,18H,9-11H2,1-6H3;1H/q+1;/p-1/t18-;/m0./s1
InChIKey SANXPMGEBDLSJX-FERBBOLQSA-M
Mol Weight 499.38947 g/mol
Molecular Formula C22H30INO4
Exact Mass 499.121953 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Eo42FhXRIbh
Name O,O'-dimethyl-Magnoflorin iodide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H30INO4
InChI InChI=1S/C22H30NO4.HI/c1-23(2)10-9-16-13-21(26-5)22(27-6)14-17(16)18(23)11-15-7-8-19(24-3)20(12-15)25-4;/h7-8,12-14,18H,9-11H2,1-6H3;1H/q+1;/p-1/t18-;/m0./s1
InChIKey SANXPMGEBDLSJX-FERBBOLQSA-M
Literature Reference DOI 10.1002/ardp.19813140311
Molecular Weight 499.389 g/mol
SMILES c1(cc2c(cc1OC)[C@@]([N+](CC2)(C)C)(Cc1cc(c(cc1)OC)OC)[H])OC.[I-]
SPLASH splash10-0a4i-6590000000-7ec203c1e3813f7425f9
Source of Spectrum APC-314-256-4
Synonyms (S)-1-(3,4-dimethoxybenzyl)-6,7-dimethoxy-2,2-dimethyl-1,2,3,4-tetrahydroisoquinolin-2-ium iodide
Wiley ID 1787923