| SpectraBase Spectrum ID |
3g6MIhJc27D |
| Name |
3-(1,1-Dioxido-3-oxo-1,2-benzisothiazol-2(3H)-yl)propanoic acid, tms derivative |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
327.059670355 u |
| Formula |
C13H17NO5SSi |
| InChI |
InChI=1S/C13H17NO5SSi/c1-21(2,3)19-12(15)8-9-14-13(16)10-6-4-5-7-11(10)20(14,17)18/h4-7H,8-9H2,1-3H3 |
| InChIKey |
MPRXARVWBJDEKN-UHFFFAOYSA-N |
| Molecular Weight |
327.426 g/mol |
| SMILES |
C(CCN1S(C2=C(C1=O)C=CC=C2)(=O)=O)(=O)O[Si](C)(C)C |
