| SpectraBase Spectrum ID |
73bcmyMWNF9 |
| Name |
3-Benzoylmethyl-2-methylthio-6-(4-chlorophenyl)pyrimidinium Iodide |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C19H16ClIN2OS |
| InChI |
InChI=1S/C19H16ClN2OS.HI/c1-24-19-21-17(14-7-9-16(20)10-8-14)11-12-22(19)13-18(23)15-5-3-2-4-6-15;/h2-12H,13H2,1H3;1H/q+1;/p-1 |
| InChIKey |
CCDJAAKMBMUQBJ-UHFFFAOYSA-M |
| Molecular Weight |
482.767 g/mol |
| SMILES |
[I-].c1([n+](ccc(n1)-c1ccc(Cl)cc1)CC(=O)c1ccccc1)SC |
| SPLASH |
splash10-0a6r-6910000000-cf164178590e7b4291c5 |
| Source of Spectrum |
SO-0-817-9 |
| Synonyms |
4-(4-Chlorophenyl)-2-(methylsulfanyl)-1-(2-oxo-2-phenylethyl)pyrimidin-1-ium iodide |
| Wiley ID |
1540198 |
