| SpectraBase Compound ID | 5T3GgxjFCSP |
|---|---|
| InChI | InChI=1S/C9H9ClO/c10-9-5-3-8(4-6-9)2-1-7-11/h3-7H,1-2H2 |
| InChIKey | UXIFTAZOVKVCBX-UHFFFAOYSA-N |
| Mol Weight | 168.62 g/mol |
| Molecular Formula | C9H9ClO |
| Exact Mass | 168.034193 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 9Ac6LPAuRVM |
|---|---|
| Name | 3-(4-Chlorophenyl)propanal |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C9H9ClO |
| InChI | InChI=1S/C9H9ClO/c10-9-5-3-8(4-6-9)2-1-7-11/h3-7H,1-2H2 |
| InChIKey | UXIFTAZOVKVCBX-UHFFFAOYSA-N |
| Literature Reference DOI | 10.1039/C5OB00378D |
| Molecular Weight | 168.623 g/mol |
| SMILES | C(CCc1ccc(cc1)Cl)=O |
| SPLASH | splash10-004i-4900000000-161d76bbdcda39b25e52 |
| Source of Spectrum | F5-13-4632/SM13-12_L |
| Wiley ID | 1804636 |