| SpectraBase Compound ID | FzNcqiI6mVH |
|---|---|
| InChI | InChI=1S/C16H15BrFNO/c1-2-13(11-6-4-3-5-7-11)16(20)19-15-9-8-12(17)10-14(15)18/h3-10,13H,2H2,1H3,(H,19,20) |
| InChIKey | MGKWGLBGFIJQPB-UHFFFAOYSA-N |
| Mol Weight | 336.2 g/mol |
| Molecular Formula | C16H15BrFNO |
| Exact Mass | 335.032105 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5ayNYYJtUTD |
|---|---|
| Name | N-(4-Bromo-2-fluorophenyl)-2-phenylbutanamide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 335.032105269 u |
| Formula | C16H15BrFNO |
| InChI | InChI=1S/C16H15BrFNO/c1-2-13(11-6-4-3-5-7-11)16(20)19-15-9-8-12(17)10-14(15)18/h3-10,13H,2H2,1H3,(H,19,20) |
| InChIKey | MGKWGLBGFIJQPB-UHFFFAOYSA-N |
| Molecular Weight | 336.204 g/mol |
| SMILES | C1(F)=C(C=CC(=C1)Br)NC(=O)C(CC)C1=CC=CC=C1 |