![2-Acetylpyridine 4-[2-thiazolyl]-3-thiosemicarbazone](/api/spectrum/8rqCCWALVmc/structure.png?h=300&w=458 "2-Acetylpyridine 4-[2-thiazolyl]-3-thiosemicarbazone")
| SpectraBase Compound ID | DxKZo5rngE6 |
|---|---|
| InChI | InChI=1S/C11H11N5S2/c1-8(9-4-2-3-5-12-9)15-16-10(17)14-11-13-6-7-18-11/h2-7H,1H3,(H2,13,14,16,17)/b15-8- |
| InChIKey | ZKDZODSVPQCQJV-NVNXTCNLSA-N |
| Mol Weight | 277.36 g/mol |
| Molecular Formula | C11H11N5S2 |
| Exact Mass | 277.045588 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8rqCCWALVmc |
|---|---|
| Name | 2-Acetylpyridine 4-[2-thiazolyl]-3-thiosemicarbazone |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 277.045587722 u |
| Formula | C11H11N5S2 |
| InChI | InChI=1S/C11H11N5S2/c1-8(9-4-2-3-5-12-9)15-16-10(17)14-11-13-6-7-18-11/h2-7H,1H3,(H2,13,14,16,17)/b15-8- |
| InChIKey | ZKDZODSVPQCQJV-NVNXTCNLSA-N |
| Molecular Weight | 277.364 g/mol |
| SMILES | C1=CC=CC(=N1)\C(=N/NC(NC1=NC=CS1)=S)C |