| SpectraBase Compound ID | Ji9XrWq60M2 |
|---|---|
| InChI | InChI=1S/C10H11ClO2/c1-8(12)9-4-2-3-5-10(9)13-7-6-11/h2-5H,6-7H2,1H3 |
| InChIKey | FZXVDBULFTUKTM-UHFFFAOYSA-N |
| Mol Weight | 198.65 g/mol |
| Molecular Formula | C10H11ClO2 |
| Exact Mass | 198.044757 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 8UBuKbWCdWC |
|---|---|
| Name | 2-Chloroethoxyacetophenone |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 198.044757292 u |
| Formula | C10H11ClO2 |
| InChI | InChI=1S/C10H11ClO2/c1-8(12)9-4-2-3-5-10(9)13-7-6-11/h2-5H,6-7H2,1H3 |
| InChIKey | FZXVDBULFTUKTM-UHFFFAOYSA-N |
| Molecular Weight | 198.649 g/mol |
| SMILES | C1=CC(=C(C=C1)OCCCl)C(=O)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.942749 |