| SpectraBase Compound ID | D3Qirn8tCqP |
|---|---|
| InChI | InChI=1S/C10H9ClO3/c11-6-7-14-10(13)9(12)8-4-2-1-3-5-8/h1-5H,6-7H2 |
| InChIKey | HXEWPRCEKAHMHV-UHFFFAOYSA-N |
| Mol Weight | 212.63 g/mol |
| Molecular Formula | C10H9ClO3 |
| Exact Mass | 212.024022 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 7JiL8LEO1Fo |
|---|---|
| Name | 2-Chloroethyl 2-oxidanylidene-2-phenyl-ethanoate |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 212.024021847 u |
| Formula | C10H9ClO3 |
| InChI | InChI=1S/C10H9ClO3/c11-6-7-14-10(13)9(12)8-4-2-1-3-5-8/h1-5H,6-7H2 |
| InChIKey | HXEWPRCEKAHMHV-UHFFFAOYSA-N |
| Molecular Weight | 212.632 g/mol |
| SMILES | C(C(=O)OCCCl)(=O)C1=CC=CC=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.823628 |