![N-Methyl-2,3,9,10-tetramethoxy-5,6,12,12a-tetrahydroindolo[2,1-a]isoquinolinium iodide](/api/spectrum/4fcu7dhLJUG/structure.png?h=300&w=458 "N-Methyl-2,3,9,10-tetramethoxy-5,6,12,12a-tetrahydroindolo[2,1-a]isoquinolinium iodide")
| SpectraBase Compound ID | HDkgb4bFnBs |
|---|---|
| InChI | InChI=1S/C21H26NO4.HI/c1-22-7-6-13-9-18(23-2)20(25-4)11-15(13)17(22)8-14-10-19(24-3)21(26-5)12-16(14)22;/h9-12,17H,6-8H2,1-5H3;1H/q+1;/p-1 |
| InChIKey | QDDWSCZKZVYINU-UHFFFAOYSA-M |
| Mol Weight | 483.35 g/mol |
| Molecular Formula | C21H26INO4 |
| Exact Mass | 483.090653 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 4fcu7dhLJUG |
|---|---|
| Name | N-Methyl-2,3,9,10-tetramethoxy-5,6,12,12a-tetrahydroindolo[2,1-a]isoquinolinium iodide |
| Comments | Less than 3 mono-isotopic peaks |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C21H26INO4 |
| InChI | InChI=1S/C21H26NO4.HI/c1-22-7-6-13-9-18(23-2)20(25-4)11-15(13)17(22)8-14-10-19(24-3)21(26-5)12-16(14)22;/h9-12,17H,6-8H2,1-5H3;1H/q+1;/p-1 |
| InChIKey | QDDWSCZKZVYINU-UHFFFAOYSA-M |
| Molecular Weight | 483.346 g/mol |
| SMILES | [I-].C12[N+](CCc3cc(c(cc23)OC)OC)(c2c(C1)cc(c(c2)OC)OC)C |
| SPLASH | splash10-004l-0009000000-2153a41c1e7303bda25c |
| Source of Spectrum | H1-53-1047-11 |
| Synonyms | 2,3,9,10-tetramethoxy-7-methyl-5,6,12,12a-tetrahydroindolo[2,1-a]isoquinolin-7-ium iodide 2,3,9,10-tetramethoxy-7-methyl-5,6,12,12a-tetrahydroindolo[2,1-a]isoquinolinium iodide 2,3,9,10-tetramethoxy-7-methyl-5,6,12,12a-tetrahydroindol[2,1-a]isoquinolin-7-ium iodide 2,3,9,10-tetramethoxy-7-methyl-5,6,12,12a-tetrahydroindolo[2,1-a]isoquinolin-7-ium;iodide |
| Wiley ID | 817975 |