![p-Fluorobenzaldehyde 4-[3-pyridyl]-3-thiosemicarbazone](/api/spectrum/6lsotkK3M80/structure.png?h=300&w=458 "p-Fluorobenzaldehyde 4-[3-pyridyl]-3-thiosemicarbazone")
| SpectraBase Compound ID | EH91pjIKUIP |
|---|---|
| InChI | InChI=1S/C13H11FN4S/c14-11-5-3-10(4-6-11)8-16-18-13(19)17-12-2-1-7-15-9-12/h1-9H,(H2,17,18,19)/b16-8+ |
| InChIKey | HQOQIUZLQCWHRZ-LZYBPNLTSA-N |
| Mol Weight | 274.32 g/mol |
| Molecular Formula | C13H11FN4S |
| Exact Mass | 274.068846 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6lsotkK3M80 |
|---|---|
| Name | p-Fluorobenzaldehyde 4-[3-pyridyl]-3-thiosemicarbazone |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 274.068845707 u |
| Formula | C13H11FN4S |
| InChI | InChI=1S/C13H11FN4S/c14-11-5-3-10(4-6-11)8-16-18-13(19)17-12-2-1-7-15-9-12/h1-9H,(H2,17,18,19)/b16-8+ |
| InChIKey | HQOQIUZLQCWHRZ-LZYBPNLTSA-N |
| Molecular Weight | 274.317 g/mol |
| SMILES | C1=C(C=CC(=C1)F)\C=N\NC(NC1=CC=CN=C1)=S |