| SpectraBase Spectrum ID |
3z6bzBAhjls |
| Name |
3-(2,6-Dimethyl-1,3-benzothiazol-3-ium-3-yl)-1-propanesulfonate |
| Alternate Name(s) |
3-(2,6-dimethyl-1,3-benzothiazol-3-ium-3-yl)propane-1-sulfonate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C12H15NO3S2 |
| InChI |
InChI=1S/C12H15NO3S2/c1-9-4-5-11-12(8-9)17-10(2)13(11)6-3-7-18(14,15)16/h4-5,8H,3,6-7H2,1-2H3 |
| InChIKey |
BSYDQFCXERHXKZ-UHFFFAOYSA-N |
| Molecular Weight |
285.376 g/mol |
| SMILES |
c12ccc(cc2sc([n+]1CCCS(=O)([O-])=O)C)C |
| SPLASH |
splash10-03k9-9700000000-4aa5f7e2f1f6af90539b |
| Wiley ID |
1439350 |
