| SpectraBase Compound ID | CsCtnXEt47f |
|---|---|
| InChI | InChI=1S/C7H4N2O5S/c10-7-5-2-1-4(9(11)12)3-6(5)15(13,14)8-7/h1-3H,(H,8,10) |
| InChIKey | HZZFBUZSKAVIOV-UHFFFAOYSA-N |
| Mol Weight | 228.18 g/mol |
| Molecular Formula | C7H4N2O5S |
| Exact Mass | 227.984092 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | EvZwHFtOlue |
|---|---|
| Name | 1,1-Diketo-6-nitro-1,2-benzothiazol-3-one |
| CAS Registry Number | 22952-24-5 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C7H4N2O5S |
| InChI | InChI=1S/C7H4N2O5S/c10-7-5-2-1-4(9(11)12)3-6(5)15(13,14)8-7/h1-3H,(H,8,10) |
| InChIKey | HZZFBUZSKAVIOV-UHFFFAOYSA-N |
| Molecular Weight | 228.178 g/mol |
| SMILES | N1C(c2c(S1(=O)=O)cc(cc2)N(=O)=O)=O |
| SPLASH | splash10-004i-9420000000-43899d2b133823fd93d1 |
| Synonyms | 6-Nitro-1,2-benzisothiazol-3(2H)-one 1,1-dioxide 1,2-Benzisothiazol-3(2H)-one, 6-nitro-, 1,1-dioxide 1,2-Benzisothiazolin-3-one, 6-nitro-, 1,1-dioxide 6-Nitro-1,1-bis(oxidanylidene)-1,2-benzothiazol-3-one 6-Nitro-1,1-dioxo-1,2-benzothiazol-3-one 6-Nitro-1,1-dioxo-1,2-dihydro-1.lambda.(6)-benzo[d]isothiazol-3-one 6-Nitro-2,3-dihydro-1H-1.lambda.-6-benzo[d]isothiazole-1,1,3-trione NSC 358278 |
| Wiley ID | 1458247 |