| SpectraBase Spectrum ID |
7XVR1RfzKAh |
| Name |
2-Phenyl-5-(3-trifluoromethylphenyl)-1,2-thiazolium perchlorate |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C16H11ClF3NO4S |
| InChI |
InChI=1S/C16H11F3NS.ClHO4/c17-16(18,19)13-6-4-5-12(11-13)15-9-10-20(21-15)14-7-2-1-3-8-14;2-1(3,4)5/h1-11H;(H,2,3,4,5)/q+1;/p-1 |
| InChIKey |
MXUQCFUELXDEFI-UHFFFAOYSA-M |
| Molecular Weight |
405.775 g/mol |
| SMILES |
[Cl]([O-])(=O)(=O)=O.c1(s[n+](cc1)-c1ccccc1)-c1cc(C(F)(F)F)ccc1 |
| SPLASH |
splash10-0006-9000000000-57c9c0f04e4832d75200 |
| Source of Spectrum |
O1-30-1458-9 |
| Synonyms |
2-phenyl-5-[3-(trifluoromethyl)phenyl]isothiazol-2-ium perchlorate |
| Wiley ID |
818753 |
