| SpectraBase Compound ID | 55B9jgmE5Sx |
|---|---|
| InChI | InChI=1S/C9H8Cl2O3/c1-2-13-9(12)14-8-5-6(10)3-4-7(8)11/h3-5H,2H2,1H3 |
| InChIKey | AJTVYWLQTITVKM-UHFFFAOYSA-N |
| Mol Weight | 235.07 g/mol |
| Molecular Formula | C9H8Cl2O3 |
| Exact Mass | 233.98505 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 4zi0lrEoDXt |
|---|---|
| Name | Carbonic acid, ethyl 2,5-dichlorophenyl ester |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 233.985049515 u |
| Formula | C9H8Cl2O3 |
| InChI | InChI=1S/C9H8Cl2O3/c1-2-13-9(12)14-8-5-6(10)3-4-7(8)11/h3-5H,2H2,1H3 |
| InChIKey | AJTVYWLQTITVKM-UHFFFAOYSA-N |
| Molecular Weight | 235.066 g/mol |
| SMILES | C1=CC(Cl)=C(C=C1Cl)OC(OCC)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.958948 |