| SpectraBase Compound ID | 4tQEhJHEUcB |
|---|---|
| InChI | InChI=1S/C13H10F2N4O2/c14-9-1-2-11(10(15)7-9)17-13(21)19-18-12(20)8-3-5-16-6-4-8/h1-7H,(H,18,20)(H2,17,19,21) |
| InChIKey | DWANKMVHUAYNPK-UHFFFAOYSA-N |
| Mol Weight | 292.25 g/mol |
| Molecular Formula | C13H10F2N4O2 |
| Exact Mass | 292.077182 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | XzGR9BdBtl |
|---|---|
| Name | 4-(2,4-Difluorophenyl)-1-isonicotinoylsemicarbazide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 292.077181902 u |
| Formula | C13H10F2N4O2 |
| InChI | InChI=1S/C13H10F2N4O2/c14-9-1-2-11(10(15)7-9)17-13(21)19-18-12(20)8-3-5-16-6-4-8/h1-7H,(H,18,20)(H2,17,19,21) |
| InChIKey | DWANKMVHUAYNPK-UHFFFAOYSA-N |
| Molecular Weight | 292.246 g/mol |
| SMILES | N(C1=CC=C(C=C1F)F)C(NNC(C=1C=CN=CC1)=O)=O |