| SpectraBase Compound ID | E1XW2tC3jbm |
|---|---|
| InChI | InChI=1S/C9H9FN2O/c10-8-2-1-3-9(7(8)6-11)12-4-5-13/h1-3,12-13H,4-5H2 |
| InChIKey | DFUUWPRNRKFSAI-UHFFFAOYSA-N |
| Mol Weight | 180.18 g/mol |
| Molecular Formula | C9H9FN2O |
| Exact Mass | 180.069891 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 43blIbtUe4w |
|---|---|
| Name | 6-Fluoro-N-(2-hydroxyethyl)anthranilonitrile |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 180.069891080 u |
| Formula | C9H9FN2O |
| InChI | InChI=1S/C9H9FN2O/c10-8-2-1-3-9(7(8)6-11)12-4-5-13/h1-3,12-13H,4-5H2 |
| InChIKey | DFUUWPRNRKFSAI-UHFFFAOYSA-N |
| Molecular Weight | 180.182 g/mol |
| SMILES | N(C1=CC=CC(=C1C#N)F)CCO |