| SpectraBase Compound ID | 7c2srRGuFss |
|---|---|
| InChI | InChI=1S/C9H9ClO3/c1-2-12-9(11)13-8-5-3-4-7(10)6-8/h3-6H,2H2,1H3 |
| InChIKey | IXAWMVKFSMKEDW-UHFFFAOYSA-N |
| Mol Weight | 200.62 g/mol |
| Molecular Formula | C9H9ClO3 |
| Exact Mass | 200.024022 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 8yftQMe4F3U |
|---|---|
| Name | Carbonic acid, ethyl 3-chlorophenyl ester |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 200.024021847 u |
| Formula | C9H9ClO3 |
| InChI | InChI=1S/C9H9ClO3/c1-2-12-9(11)13-8-5-3-4-7(10)6-8/h3-6H,2H2,1H3 |
| InChIKey | IXAWMVKFSMKEDW-UHFFFAOYSA-N |
| Molecular Weight | 200.621 g/mol |
| SMILES | C1=C(C=C(C=C1)OC(OCC)=O)Cl |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.950069 |