| SpectraBase Compound ID | 5cCJshev8o6 |
|---|---|
| InChI | InChI=1S/C10H9Cl3O2/c1-10(2,13)9(14)15-8-4-3-6(11)5-7(8)12/h3-5H,1-2H3 |
| InChIKey | KRWPAIXGLLTQNK-UHFFFAOYSA-N |
| Mol Weight | 267.54 g/mol |
| Molecular Formula | C10H9Cl3O2 |
| Exact Mass | 265.966813 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 6o3pJSaj5Xp |
|---|---|
| Name | Propionic acid, 2-chloro-2-methyl-, 2,4-dichlorophenyl ester |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 265.966812628 u |
| Formula | C10H9Cl3O2 |
| InChI | InChI=1S/C10H9Cl3O2/c1-10(2,13)9(14)15-8-4-3-6(11)5-7(8)12/h3-5H,1-2H3 |
| InChIKey | KRWPAIXGLLTQNK-UHFFFAOYSA-N |
| SMILES | C(OC=1C(=CC(=CC1)Cl)Cl)(C(Cl)(C)C)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.928957 |