| SpectraBase Compound ID | DAx1BYgaX3Q |
|---|---|
| InChI | InChI=1S/C15H12ClNO2/c16-12-6-8-13(9-7-12)17-15(19)10-14(18)11-4-2-1-3-5-11/h1-9H,10H2,(H,17,19) |
| InChIKey | KOIRFNQRSJGKSY-UHFFFAOYSA-N |
| Mol Weight | 273.72 g/mol |
| Molecular Formula | C15H12ClNO2 |
| Exact Mass | 273.055656 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5SKlYE1M6Xw |
|---|---|
| Name | Propanamide, 3-oxo-3-phenyl-N-(4-chlorophenyl)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 273.055656328 u |
| Formula | C15H12ClNO2 |
| InChI | InChI=1S/C15H12ClNO2/c16-12-6-8-13(9-7-12)17-15(19)10-14(18)11-4-2-1-3-5-11/h1-9H,10H2,(H,17,19) |
| InChIKey | KOIRFNQRSJGKSY-UHFFFAOYSA-N |
| SMILES | C(C(NC1=CC=C(C=C1)Cl)=O)C(=O)C=1C=CC=CC1 |