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5,6,7-trimethoxy-1-[(4-methoxyphenyl)methyl]-2-methyl-isoquinolin-2-ium
SpectraBase Compound ID LmtSH0U9jou
InChI InChI=1S/C21H24NO4/c1-22-11-10-16-17(13-19(24-3)21(26-5)20(16)25-4)18(22)12-14-6-8-15(23-2)9-7-14/h6-11,13H,12H2,1-5H3/q+1
InChIKey QEYACURRVKYESS-UHFFFAOYSA-N
Mol Weight 354.43 g/mol
Molecular Formula C21H24NO4
Exact Mass 354.170533 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FTeZAEDMefS
Name 5,6,7-trimethoxy-1-[(4-methoxyphenyl)methyl]-2-methyl-isoquinolin-2-ium
Alternate Name(s) 5,6,7-trimethoxy-2-methyl-1-p-anisyl-isoquinolin-2-ium
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H24NO4
InChI InChI=1S/C21H24NO4/c1-22-11-10-16-17(13-19(24-3)21(26-5)20(16)25-4)18(22)12-14-6-8-15(23-2)9-7-14/h6-11,13H,12H2,1-5H3/q+1
InChIKey QEYACURRVKYESS-UHFFFAOYSA-N
Molecular Weight 354.426 g/mol
SMILES c1([n+](ccc2c(c(c(cc12)OC)OC)OC)C)Cc1ccc(cc1)OC
SPLASH splash10-0fki-0529000000-d5a75bc7c6f706c97cc0
Source of Spectrum X2-45-706-3
Wiley ID 1601046