basic_info |
|
| Product_Name： | TOLOCONIUM METILSULFATE |
| CAS： | 552-92-1 |
| EnglishSynonyms： | TOLOCONIUM METILSULFATE |
| pro_mdlNumber： | MFCD00867789 |
| pro_acceptors： | 1 |
| pro_donors： | 0 |
| pro_smile： | CCCCCCCCCCCC(c1ccc(cc1)C)[N+](C)(C)C.COS(=O)(=O)[O-] |
| InChi： | InChI=1S/C22H40N.CH4O4S/c1-6-7-8-9-10-11-12-13-14-15-22(23(3,4)5)21-18-16-20(2)17-19-21;1-5-6(2,3)4/h16-19,22H,6-15H2,1-5H3;1H3,(H,2,3,4)/q+1;/p-1 |
| InChiKey： | InChIKey=RCIULPORFWIVEE-UHFFFAOYSA-M |
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