| SpectraBase Compound ID | EOscXsT7aqQ |
|---|---|
| InChI | InChI=1S/C16H15ClFNO/c1-2-13(11-6-4-3-5-7-11)16(20)19-12-8-9-15(18)14(17)10-12/h3-10,13H,2H2,1H3,(H,19,20) |
| InChIKey | KMDLWZQKWPLBTQ-UHFFFAOYSA-N |
| Mol Weight | 291.75 g/mol |
| Molecular Formula | C16H15ClFNO |
| Exact Mass | 291.08262 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DkvOon9M3r2 |
|---|---|
| Name | Benzeneacetamide, N-(3-chloro-4-fluorophenyl)-alpha-ethyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 291.082619969 u |
| Formula | C16H15ClFNO |
| InChI | InChI=1S/C16H15ClFNO/c1-2-13(11-6-4-3-5-7-11)16(20)19-12-8-9-15(18)14(17)10-12/h3-10,13H,2H2,1H3,(H,19,20) |
| InChIKey | KMDLWZQKWPLBTQ-UHFFFAOYSA-N |
| Molecular Weight | 291.753 g/mol |
| SMILES | N(C(C(C1=CC=CC=C1)CC)=O)C=1C=C(Cl)C(=CC1)F |