| SpectraBase Compound ID | GXeQYskO5t9 |
|---|---|
| InChI | InChI=1S/C10H11ClO3/c1-13-7-3-4-8(9(12)6-11)10(5-7)14-2/h3-5H,6H2,1-2H3 |
| InChIKey | CWNPZROBLGHLIW-UHFFFAOYSA-N |
| Mol Weight | 214.65 g/mol |
| Molecular Formula | C10H11ClO3 |
| Exact Mass | 214.039672 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | KbF1W0D9LxH |
|---|---|
| Name | 2-Chloro-1-(2,4-dimethoxyphenyl)ethanone |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 214.039671911 u |
| Formula | C10H11ClO3 |
| InChI | InChI=1S/C10H11ClO3/c1-13-7-3-4-8(9(12)6-11)10(5-7)14-2/h3-5H,6H2,1-2H3 |
| InChIKey | CWNPZROBLGHLIW-UHFFFAOYSA-N |
| Molecular Weight | 214.648 g/mol |
| SMILES | C=1(C(=CC(=CC1)OC)OC)C(CCl)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.903057 |