![1-[2-Acetylpyridine]-4-[3-methylphenyl]-3-thiosemicarbazone](/api/spectrum/GKjDa5yXiQ1/structure.png?h=300&w=458 "1-[2-Acetylpyridine]-4-[3-methylphenyl]-3-thiosemicarbazone")
| SpectraBase Compound ID | GJ7FSUqiAdV |
|---|---|
| InChI | InChI=1S/C15H16N4S/c1-11-6-5-7-13(10-11)17-15(20)19-18-12(2)14-8-3-4-9-16-14/h3-10H,1-2H3,(H2,17,19,20)/b18-12+ |
| InChIKey | ANJKHGQGRYJRCY-LDADJPATSA-N |
| Mol Weight | 284.38 g/mol |
| Molecular Formula | C15H16N4S |
| Exact Mass | 284.109568 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | GKjDa5yXiQ1 |
|---|---|
| Name | 1-[2-Acetylpyridine]-4-[3-methylphenyl]-3-thiosemicarbazone |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 284.109567705 u |
| Formula | C15H16N4S |
| InChI | InChI=1S/C15H16N4S/c1-11-6-5-7-13(10-11)17-15(20)19-18-12(2)14-8-3-4-9-16-14/h3-10H,1-2H3,(H2,17,19,20)/b18-12+ |
| InChIKey | ANJKHGQGRYJRCY-LDADJPATSA-N |
| Molecular Weight | 284.381 g/mol |
| SMILES | C(N\N=C\(C=1C=CC=CN1)C)(NC1=CC=CC(=C1)C)=S |