| SpectraBase Compound ID | 2dMLLCYKIkn |
|---|---|
| InChI | InChI=1S/C10H11ClO/c1-7(2)10(12)8-4-3-5-9(11)6-8/h3-7H,1-2H3 |
| InChIKey | UVZXOZZFQHKFDK-UHFFFAOYSA-N |
| Mol Weight | 182.65 g/mol |
| Molecular Formula | C10H11ClO |
| Exact Mass | 182.049843 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JrR2UDd1ILx |
|---|---|
| Name | 1-Propanone, 1-(3-chlorophenyl)-2-methyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 182.049842673 u |
| Formula | C10H11ClO |
| InChI | InChI=1S/C10H11ClO/c1-7(2)10(12)8-4-3-5-9(11)6-8/h3-7H,1-2H3 |
| InChIKey | UVZXOZZFQHKFDK-UHFFFAOYSA-N |
| Molecular Weight | 182.650 g/mol |
| SMILES | C(C(=O)C1=CC(Cl)=CC=C1)(C)C |