| SpectraBase Compound ID | C04b7UGbl0C |
|---|---|
| InChI | InChI=1S/C16H18N4S/c1-13(15-10-6-7-11-17-15)18-19-16(21)20(2)12-14-8-4-3-5-9-14/h3-11H,12H2,1-2H3,(H,19,21)/b18-13- |
| InChIKey | ZVGFLLUQOKYCJT-AQTBWJFISA-N |
| Mol Weight | 298.41 g/mol |
| Molecular Formula | C16H18N4S |
| Exact Mass | 298.125218 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GHV6WulWUC3 |
|---|---|
| Name | 2-Acetylpyridine 4-benzyl-4-methylthiosemicarbazone |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 298.125217770 u |
| Formula | C16H18N4S |
| InChI | InChI=1S/C16H18N4S/c1-13(15-10-6-7-11-17-15)18-19-16(21)20(2)12-14-8-4-3-5-9-14/h3-11H,12H2,1-2H3,(H,19,21)/b18-13- |
| InChIKey | ZVGFLLUQOKYCJT-AQTBWJFISA-N |
| SMILES | C(N\N=C\(C)C1=CC=CC=N1)(N(CC1=CC=CC=C1)C)=S |