| SpectraBase Compound ID | BSEHTD6Ovkc |
|---|---|
| InChI | InChI=1S/C8H12N4S/c1-9-8(13)11-10-6-7-4-3-5-12(7)2/h3-6H,1-2H3,(H2,9,11,13)/b10-6+ |
| InChIKey | WPEQZCWRJFUZDZ-UXBLZVDNSA-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 | IDSJF8VkJ9B |
|---|---|
| Name | 1-Methylpyrrole-2-carboxaldehyde, 4-methyl-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/c1-9-8(13)11-10-6-7-4-3-5-12(7)2/h3-6H,1-2H3,(H2,9,11,13)/b10-6+ |
| InChIKey | WPEQZCWRJFUZDZ-UXBLZVDNSA-N |
| SMILES | N(\N=C\C1=CC=CN1C)C(=S)NC |