| SpectraBase Spectrum ID |
36diVY4D7MB |
| Name |
4,4'-bis(Methylthio)benzhydryl-ammonium 4-toluenesulfonate |
| Alternate Name(s) |
bis[4-(methylsulfanyl)phenyl]methanaminium 4-methylbenzenesulfonate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C22H25NO3S3 |
| InChI |
InChI=1S/C15H17NS2.C7H8O3S/c1-17-13-7-3-11(4-8-13)15(16)12-5-9-14(18-2)10-6-12;1-6-2-4-7(5-3-6)11(8,9)10/h3-10,15H,16H2,1-2H3;2-5H,1H3,(H,8,9,10) |
| InChIKey |
YQXBPRWUWKVXNW-UHFFFAOYSA-N |
| Molecular Weight |
447.626 g/mol |
| SMILES |
[NH3+]C(c1ccc(cc1)SC)c1ccc(cc1)SC.c1(S([O-])(=O)=O)ccc(cc1)C |
| SPLASH |
splash10-0udi-0950000000-362d2730841aab8e9c49 |
| Source of Spectrum |
G-57-519-0 |
| Wiley ID |
813282 |
