| SpectraBase Spectrum ID |
Gqyk8Q343Hu |
| Name |
1,1-diketo-4,5-dimethyl-2-(4-nitrophenyl)-3H-isothiazol-3-ol |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C11H12N2O5S |
| InChI |
InChI=1S/C11H12N2O5S/c1-7-8(2)19(17,18)12(11(7)14)9-3-5-10(6-4-9)13(15)16/h3-6,11,14H,1-2H3 |
| InChIKey |
LBRUOGHIIPNWAH-UHFFFAOYSA-N |
| Molecular Weight |
284.286 g/mol |
| SMILES |
OC1N(S(C(=C1C)C)(=O)=O)c1ccc(cc1)N(=O)=O |
| SPLASH |
splash10-014i-0090000000-6bec9a9b375602bf3fbe |
| Source of Spectrum |
C5-2003-2267-10 |
| Synonyms |
4,5-dimethyl-2-(4-nitrophenyl)-1,1-bis(oxidanylidene)-3H-1,2-thiazol-3-ol
4,5-dimethyl-2-(4-nitrophenyl)-1,1-dioxo-3H-1,2-thiazol-3-ol
4,5-dimethyl-2-(4-nitrophenyl)-1,1-dioxo-3H-isothiazol-3-ol |
| Wiley ID |
1616014 |
