| SpectraBase Compound ID | AUSUJoh54Md |
|---|---|
| InChI | InChI=1S/C9H8N4O4S2/c10-9(18)13-12-7-5-3-4(19(15,16)17)1-2-6(5)11-8(7)14/h1-3H,(H3,10,13,18)(H,11,12,14)(H,15,16,17) |
| InChIKey | WUCGCPKUJCSTEJ-UHFFFAOYSA-N |
| Mol Weight | 300.31 g/mol |
| Molecular Formula | C9H8N4O4S2 |
| Exact Mass | 299.998697 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | FCagw3Ob0RM |
|---|---|
| Name | 5-SULFOISATIN-BETA-THIOSEMICARBAZONE;(LE-CONFORMATION) |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C9H8N4O4S2 |
| InChI | InChI=1S/C9H8N4O4S2/c10-9(18)13-12-7-5-3-4(19(15,16)17)1-2-6(5)11-8(7)14/h1-3H,(H3,10,13,18)(H,11,12,14)(H,15,16,17) |
| InChIKey | WUCGCPKUJCSTEJ-UHFFFAOYSA-N |
| Literature Reference Author | H.STUENZI |
| Literature Reference Citation | AUSTR.J.CHEM.,34,373(1981) |
| Literature Reference DOI | 10.1071/ch9810373 |
| Molecular Weight | 300.307 g/mol |
| Solvent | D2O |
| Source File Reference | UWED2522 |