| SpectraBase Compound ID | LSTdQUaoNqJ |
|---|---|
| InChI | InChI=1S/C9H7ClO2/c1-6(11)9(12)7-2-4-8(10)5-3-7/h2-5H,1H3 |
| InChIKey | HOZREFFNUJAHQP-UHFFFAOYSA-N |
| Mol Weight | 182.61 g/mol |
| Molecular Formula | C9H7ClO2 |
| Exact Mass | 182.013457 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 7MOwwQ6VuOx |
|---|---|
| Name | 1-(4-Chlorophenyl)propan-1,2-dione |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 182.013457163 u |
| Formula | C9H7ClO2 |
| InChI | InChI=1S/C9H7ClO2/c1-6(11)9(12)7-2-4-8(10)5-3-7/h2-5H,1H3 |
| InChIKey | HOZREFFNUJAHQP-UHFFFAOYSA-N |
| Molecular Weight | 182.606 g/mol |
| SMILES | C=1(C(C(=O)C)=O)C=CC(=CC1)Cl |