| SpectraBase Spectrum ID |
5jqR5DY7JDu |
| Name |
2-(1-pyridin-1-iumyl)propanedioic acid diethyl ester |
| Alternate Name(s) |
2-Pyridin-1-ium-1-ylmalonic acid diethyl ester
Diethyl 2-pyridin-1-ium-1-ylpropanedioate |
| CAS Registry Number |
17281-71-9 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C12H16NO4 |
| InChI |
InChI=1S/C12H16NO4/c1-3-16-11(14)10(12(15)17-4-2)13-8-6-5-7-9-13/h5-10H,3-4H2,1-2H3/q+1 |
| InChIKey |
QJNLGWWNCFWCFT-UHFFFAOYSA-N |
| Molecular Weight |
238.263 g/mol |
| SMILES |
C([n+]1ccccc1)(C(=O)OCC)C(=O)OCC |
| SPLASH |
splash10-0006-9400000000-295468f9848ff9cfcff0 |
| Source of Spectrum |
O-19-287-6 |
| Wiley ID |
1239463 |
