| SpectraBase Compound ID | 3Iy8eGP39e2 |
|---|---|
| InChI | InChI=1S/C13H9ClFNO2/c14-9-3-6-12(17)11(7-9)16-13(18)8-1-4-10(15)5-2-8/h1-7,17H,(H,16,18) |
| InChIKey | PXBIMOHSXYTDEU-UHFFFAOYSA-N |
| Mol Weight | 265.67 g/mol |
| Molecular Formula | C13H9ClFNO2 |
| Exact Mass | 265.030584 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | A60EkXBAaQ1 |
|---|---|
| Name | Benzamide, 4-fluoro-N-(5-chloro-2-hydroxyphenyl)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 265.030584395 u |
| Formula | C13H9ClFNO2 |
| InChI | InChI=1S/C13H9ClFNO2/c14-9-3-6-12(17)11(7-9)16-13(18)8-1-4-10(15)5-2-8/h1-7,17H,(H,16,18) |
| InChIKey | PXBIMOHSXYTDEU-UHFFFAOYSA-N |
| Molecular Weight | 265.671 g/mol |
| SMILES | C(NC1=C(O)C=CC(=C1)Cl)(C=1C=CC(=CC1)F)=O |