| SpectraBase Compound ID | 7g4oh1zmqRE |
|---|---|
| InChI | InChI=1S/C6H6N4O3S/c7-6(11)9-8-3-4-1-2-5(14-4)10(12)13/h1-3H,(H3,7,9,11)/b8-3+ |
| InChIKey | UCLHQQFTMJFOKW-FPYGCLRLSA-N |
| Mol Weight | 214.2 g/mol |
| Molecular Formula | C6H6N4O3S |
| Exact Mass | 214.016061 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | L3EX31HvGgY |
|---|---|
| Name | 5-Nitrothiophene-2-carboxaldehyde semicarbazone |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 214.016061240 u |
| Formula | C6H6N4O3S |
| InChI | InChI=1S/C6H6N4O3S/c7-6(11)9-8-3-4-1-2-5(14-4)10(12)13/h1-3H,(H3,7,9,11)/b8-3+ |
| InChIKey | UCLHQQFTMJFOKW-FPYGCLRLSA-N |
| Molecular Weight | 214.199 g/mol |
| SMILES | C1(=CC=C(S1)N(=O)=O)\C=N\NC(N)=O |