![1-Phenyl-5-[(3-pyridyl)methylene]-3-thiocarbohydrazide](/api/spectrum/6hqgP5uEC28/structure.png?h=300&w=458 "1-Phenyl-5-[(3-pyridyl)methylene]-3-thiocarbohydrazide")
| SpectraBase Compound ID | EFLB67gFM3d |
|---|---|
| InChI | InChI=1S/C13H13N5S/c19-13(18-16-12-6-2-1-3-7-12)17-15-10-11-5-4-8-14-9-11/h1-10,16H,(H2,17,18,19)/b15-10+ |
| InChIKey | BBOAFUPKWUCFLX-XNTDXEJSSA-N |
| Mol Weight | 271.34 g/mol |
| Molecular Formula | C13H13N5S |
| Exact Mass | 271.089167 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6hqgP5uEC28 |
|---|---|
| Name | 1-Phenyl-5-[(3-pyridyl)methylene]-3-thiocarbohydrazide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 271.089166613 u |
| Formula | C13H13N5S |
| InChI | InChI=1S/C13H13N5S/c19-13(18-16-12-6-2-1-3-7-12)17-15-10-11-5-4-8-14-9-11/h1-10,16H,(H2,17,18,19)/b15-10+ |
| InChIKey | BBOAFUPKWUCFLX-XNTDXEJSSA-N |
| SMILES | N(\N=C\C1=CN=CC=C1)C(NNC=1C=CC=CC1)=S |