| SpectraBase Spectrum ID |
CROIZQAkmJz |
| Name |
2-(4-Nitrobenzoylamino)-4,5-dimethyl-3-hydroperoxy-2,3-dihydroisothiazole 1-oxide |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C12H13N3O6S |
| InChI |
InChI=1S/C12H13N3O6S/c1-7-8(2)22(20)14(12(7)21-19)13-11(16)9-3-5-10(6-4-9)15(17)18/h3-6,12,19H,1-2H3,(H,13,16) |
| InChIKey |
LPKCEUMRLQUYNC-UHFFFAOYSA-N |
| Molecular Weight |
327.311 g/mol |
| SMILES |
OOC1C(=C(S(N1NC(c1ccc(cc1)N(=O)=O)=O)=O)C)C |
| SPLASH |
splash10-0udi-0970000000-381cd1fa1bf5696aadb2 |
| Source of Spectrum |
O1-65-2713-6 |
| Synonyms |
N-(3-hydroperoxy-4,5-dimethyl-1-oxido-2(3H)-isothiazolyl)-4-nitrobenzamide |
| Wiley ID |
1593328 |
