| SpectraBase Compound ID | 4n2MpXF9CaF |
|---|---|
| InChI | InChI=1S/C16H16ClNO/c1-2-13(12-8-4-3-5-9-12)16(19)18-15-11-7-6-10-14(15)17/h3-11,13H,2H2,1H3,(H,18,19) |
| InChIKey | CXQCWKHPAGXVCZ-UHFFFAOYSA-N |
| Mol Weight | 273.76 g/mol |
| Molecular Formula | C16H16ClNO |
| Exact Mass | 273.092042 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JpeNzPGUeU4 |
|---|---|
| Name | N-(2-Chlorophenyl)-2-phenylbutanamide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 273.092041838 u |
| Formula | C16H16ClNO |
| InChI | InChI=1S/C16H16ClNO/c1-2-13(12-8-4-3-5-9-12)16(19)18-15-11-7-6-10-14(15)17/h3-11,13H,2H2,1H3,(H,18,19) |
| InChIKey | CXQCWKHPAGXVCZ-UHFFFAOYSA-N |
| Molecular Weight | 273.763 g/mol |
| SMILES | N(C(C(C=1C=CC=CC1)CC)=O)C=1C(Cl)=CC=CC1 |