| SpectraBase Compound ID | FCN8AUod81R |
|---|---|
| InChI | InChI=1S/C9H7FN4O/c10-7-3-1-2-6(4-7)8(15)13-9-11-5-12-14-9/h1-5H,(H2,11,12,13,14,15) |
| InChIKey | AQERYHSAKUBTEX-UHFFFAOYSA-N |
| Mol Weight | 206.18 g/mol |
| Molecular Formula | C9H7FN4O |
| Exact Mass | 206.060389 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CTq0UWYntSK |
|---|---|
| Name | 3-Fluoro-N-(1H-1,2,4-triazol-3-yl)benzamide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 206.060389023 u |
| Formula | C9H7FN4O |
| InChI | InChI=1S/C9H7FN4O/c10-7-3-1-2-6(4-7)8(15)13-9-11-5-12-14-9/h1-5H,(H2,11,12,13,14,15) |
| InChIKey | AQERYHSAKUBTEX-UHFFFAOYSA-N |
| Molecular Weight | 206.180 g/mol |
| SMILES | N1C=NC(NC(C=2C=C(F)C=CC2)=O)=N1 |