| SpectraBase Spectrum ID |
9KQzWgdMltq |
| Name |
Pyrimidinium, 5-carboxy-1,2,4-trimethyl-6-phenyl-, hydroxide, inner salt |
| CAS Registry Number |
89318-04-7 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C14H14N2O2 |
| InChI |
InChI=1S/C14H14N2O2/c1-9-12(14(17)18)13(16(3)10(2)15-9)11-7-5-4-6-8-11/h4-8H,1-3H3 |
| InChIKey |
BBVYISXVJVLJRO-UHFFFAOYSA-N |
| Molecular Weight |
242.278 g/mol |
| SMILES |
c1([n+](c(nc(c1C([O-])=O)C)C)C)-c1ccccc1 |
| SPLASH |
splash10-00kb-3900000000-be98cfe184b18178cf86 |
| Source of Spectrum |
J-52-2464-3 |
| Synonyms |
1,2,4-trimethyl-6-phenylpyrimidin-1-ium-5-carboxylate
6-Phenyl-1,2,4-trimethylpyrimidinium-5-carboxylate |
| Wiley ID |
1245120 |
