| SpectraBase Spectrum ID |
A43TnzDn2Ii |
| Name |
Pyridinium, 1-(2-carboxyethyl)-4-cyano-3-hydroxy-2-methyl-, hydroxide, inner salt |
| CAS Registry Number |
87032-86-8 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C10H10N2O3 |
| InChI |
InChI=1S/C10H10N2O3/c1-7-10(15)8(6-11)2-4-12(7)5-3-9(13)14/h2,4H,3,5H2,1H3,(H-,13,14,15) |
| InChIKey |
VLLUCIRELRBPJI-UHFFFAOYSA-N |
| Molecular Weight |
206.201 g/mol |
| SMILES |
Oc1c([n+](CCC([O-])=O)ccc1C#N)C |
| SPLASH |
splash10-0a59-2900000000-647c86eca2154661e8d0 |
| Source of Spectrum |
SB-37-131-0 |
| Synonyms |
1-(3-Propionic acid)-2-methyl-4-cyanopyridinimum-3-olate
3-(4-cyano-3-hydroxy-2-methyl-1-pyridiniumyl)propanoate |
| Wiley ID |
1204038 |
