| SpectraBase Spectrum ID |
GmcKA7r23ds |
| Name |
3-Benzoylmethyl-2-methylthio-6-(4-methoxyphenyl)pyrimidinium Iodide |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C20H19IN2O2S |
| InChI |
InChI=1S/C20H19N2O2S.HI/c1-24-17-10-8-15(9-11-17)18-12-13-22(20(21-18)25-2)14-19(23)16-6-4-3-5-7-16;/h3-13H,14H2,1-2H3;1H/q+1;/p-1 |
| InChIKey |
IUBJPAQSUAKKPH-UHFFFAOYSA-M |
| Molecular Weight |
478.348 g/mol |
| SMILES |
[I-].c1([n+](ccc(n1)-c1ccc(OC)cc1)CC(=O)c1ccccc1)SC |
| SPLASH |
splash10-0a6r-7921000000-b61fa952d56e150b4cac |
| Source of Spectrum |
SO-0-817-9 |
| Synonyms |
4-(4-Methoxyphenyl)-2-(methylsulfanyl)-1-(2-oxo-2-phenylethyl)pyrimidin-1-ium iodide |
| Wiley ID |
1540199 |
