| SpectraBase Compound ID | FP25NdxHvfp |
|---|---|
| InChI | InChI=1S/C11H9ClO3/c12-8-3-1-7(2-4-8)10(13)9-5-6-15-11(9)14/h1-4,9H,5-6H2 |
| InChIKey | MAPJZANRMWCSSW-UHFFFAOYSA-N |
| Mol Weight | 224.64 g/mol |
| Molecular Formula | C11H9ClO3 |
| Exact Mass | 224.024022 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 91mactQSbgz |
|---|---|
| Name | .alpha.-p-Chlorobenzoyl-G-butyrolactone |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 224.024021847 u |
| Formula | C11H9ClO3 |
| InChI | InChI=1S/C11H9ClO3/c12-8-3-1-7(2-4-8)10(13)9-5-6-15-11(9)14/h1-4,9H,5-6H2 |
| InChIKey | MAPJZANRMWCSSW-UHFFFAOYSA-N |
| Molecular Weight | 224.643 g/mol |
| SMILES | C1=C(C(C2CCOC2=O)=O)C=CC(=C1)Cl |