| SpectraBase Compound ID | CU3aHhWp2ba |
|---|---|
| InChI | InChI=1S/C10H10N4O4S2/c1-19-10(11)14-13-8-6-4-5(20(16,17)18)2-3-7(6)12-9(8)15/h2-4H,1H3,(H2,11,14)(H,12,13,15)(H,16,17,18) |
| InChIKey | HLGYZKXRDRJZOR-UHFFFAOYSA-N |
| Mol Weight | 314.33 g/mol |
| Molecular Formula | C10H10N4O4S2 |
| Exact Mass | 314.014347 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6BgPcKI5Wo4 |
|---|---|
| Name | 5-SULFOISATIN-5-METHYLISOTHIOSEMICARBAZONE;(LE-CONFORMATION) |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C10H10N4O4S2 |
| InChI | InChI=1S/C10H10N4O4S2/c1-19-10(11)14-13-8-6-4-5(20(16,17)18)2-3-7(6)12-9(8)15/h2-4H,1H3,(H2,11,14)(H,12,13,15)(H,16,17,18) |
| InChIKey | HLGYZKXRDRJZOR-UHFFFAOYSA-N |
| Literature Reference Author | H.STUENZI |
| Literature Reference Citation | AUSTR.J.CHEM.,34,373(1981) |
| Literature Reference DOI | 10.1071/ch9810373 |
| Molecular Weight | 314.334 g/mol |
| Solvent | D2O |
| Source File Reference | UWED2529 |