| SpectraBase Compound ID | 4unp3cdZPxz |
|---|---|
| InChI | InChI=1S/C9H7ClO2/c1-6(11)9(12)7-3-2-4-8(10)5-7/h2-5H,1H3 |
| InChIKey | OXRBHYVHVKOEQX-UHFFFAOYSA-N |
| Mol Weight | 182.61 g/mol |
| Molecular Formula | C9H7ClO2 |
| Exact Mass | 182.013457 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 7HsZSZ2rOdX |
|---|---|
| Name | 1-(3-Chlorophenyl)propane-1,2-dione |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C9H7ClO2 |
| InChI | InChI=1S/C9H7ClO2/c1-6(11)9(12)7-3-2-4-8(10)5-7/h2-5H,1H3 |
| InChIKey | OXRBHYVHVKOEQX-UHFFFAOYSA-N |
| Literature Reference DOI | 10.1021/jo201029p |
| Molecular Weight | 182.606 g/mol |
| SMILES | c1(cc(C(C(=O)C)=O)ccc1)Cl |
| SPLASH | splash10-03g0-3900000000-d1af2c1c1f724cd33d1e |
| Source of Spectrum | J-76-6960-2i |
| Wiley ID | 1746773 |