| SpectraBase Compound ID | Zznd3m2LKc |
|---|---|
| InChI | InChI=1S/C9H9ClO2/c1-6(11)9(12)7-2-4-8(10)5-3-7/h2-6,11H,1H3/t6-/m0/s1 |
| InChIKey | MRBCYWADGWRLRL-LURJTMIESA-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 | 6aKEGrZ8qme |
|---|---|
| Name | (2S)-1-(4-Chlorophenyl)-2-hydroxy-1-propanone |
| 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/c1-6(11)9(12)7-2-4-8(10)5-3-7/h2-6,11H,1H3/t6-/m0/s1 |
| InChIKey | MRBCYWADGWRLRL-LURJTMIESA-N |
| Molecular Weight | 184.622 g/mol |
| SMILES | C(C1=CC=C(C=C1)Cl)(=O)[C@@](O)(C)[H] |