| SpectraBase Compound ID | C0wVbaTlXDw |
|---|---|
| InChI | InChI=1S/C9H9ClO2/c10-8-3-1-7(2-4-8)5-9(12)6-11/h1-4,11H,5-6H2 |
| InChIKey | PWBVIZZGWGITCV-UHFFFAOYSA-N |
| Mol Weight | 184.62 g/mol |
| Molecular Formula | C9H9ClO2 |
| Exact Mass | 184.029107 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Cxvfeq73cQS |
|---|---|
| Name | 1-(4-Chlorophenyl)-3-hydroxyacetone |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 184.029107228 u |
| Formula | C9H9ClO2 |
| InChI | InChI=1S/C9H9ClO2/c10-8-3-1-7(2-4-8)5-9(12)6-11/h1-4,11H,5-6H2 |
| InChIKey | PWBVIZZGWGITCV-UHFFFAOYSA-N |
| Molecular Weight | 184.622 g/mol |
| SMILES | C(=O)(CC1=CC=C(C=C1)Cl)CO |