| SpectraBase Spectrum ID |
LmJIyy5wWFI |
| Name |
Pyridinium, 4-carboxy-1-(2-carboxyethyl)-3-hydroxy-, hydroxide, inner salt |
| Alternate Name(s) |
1-(3-Propionic acid)-3-hydroxypyridinium-4-carboxlate
3-(4-carboxy-3-hydroxy-1-pyridiniumyl)propanoate |
| CAS Registry Number |
87032-85-7 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C9H9NO5 |
| InChI |
InChI=1S/C9H9NO5/c11-7-5-10(4-2-8(12)13)3-1-6(7)9(14)15/h1,3,5H,2,4H2,(H2-,11,12,13,14,15) |
| InChIKey |
YNWOXCSISOVEIW-UHFFFAOYSA-N |
| Molecular Weight |
211.173 g/mol |
| SMILES |
Oc1c(C(=O)O)cc[n+](c1)CCC([O-])=O |
| SPLASH |
splash10-00di-9600000000-52c14e4e60a898761fec |
| Source of Spectrum |
SB-37-131-0 |
| Wiley ID |
1210182 |
