| SpectraBase Spectrum ID |
7fpe1BCyzup |
| Name |
Perhydro-1,4-thiazepine-3,5-dicarboxylic acid |
| Alternate Name(s) |
1,4-thiazepane-3,5-dicarboxylic acid |
| CAS Registry Number |
56217-96-0 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C7H11NO4S |
| InChI |
InChI=1S/C7H11NO4S/c9-6(10)4-1-2-13-3-5(8-4)7(11)12/h4-5,8H,1-3H2,(H,9,10)(H,11,12) |
| InChIKey |
IGBAFIMATACJON-UHFFFAOYSA-N |
| Molecular Weight |
205.228 g/mol |
| SMILES |
N1C(CCSCC1C(=O)O)C(=O)O |
| SPLASH |
splash10-03dr-9800000000-77c519324222d2b6f76b |
| Source of Spectrum |
GC-12-16-1 |
| Wiley ID |
1203162 |
