| SpectraBase Compound ID | FnoeRPUTBUb |
|---|---|
| InChI | InChI=1S/C8H12N4S/c1-2-9-8(13)12-11-6-7-4-3-5-10-7/h3-6,10H,2H2,1H3,(H2,9,12,13)/b11-6+ |
| InChIKey | NPHZHJZPCVFARB-IZZDOVSWSA-N |
| Mol Weight | 196.27 g/mol |
| Molecular Formula | C8H12N4S |
| Exact Mass | 196.078268 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2VMxJar6jiR |
|---|---|
| Name | Pyrrole-2-carboxaldehyde, 4-ethyl-3-thiosemicarbazone |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 196.078267576 u |
| Formula | C8H12N4S |
| InChI | InChI=1S/C8H12N4S/c1-2-9-8(13)12-11-6-7-4-3-5-10-7/h3-6,10H,2H2,1H3,(H2,9,12,13)/b11-6+ |
| InChIKey | NPHZHJZPCVFARB-IZZDOVSWSA-N |
| SMILES | N(\N=C\C1=CC=CN1)C(=S)NCC |