| SpectraBase Compound ID | EY2FRHOxaeE |
|---|---|
| InChI | InChI=1S/C10H19ClO3/c1-2-13-8-9-14-10(12)6-4-3-5-7-11/h2-9H2,1H3 |
| InChIKey | FGWGBNADIWWHLL-UHFFFAOYSA-N |
| Mol Weight | 222.71 g/mol |
| Molecular Formula | C10H19ClO3 |
| Exact Mass | 222.102272 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 6XnmOyrWJ7p |
|---|---|
| Name | 6-Chlorohexanoic acid, 2-ethoxyethyl ester |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 222.102272169 u |
| Formula | C10H19ClO3 |
| InChI | InChI=1S/C10H19ClO3/c1-2-13-8-9-14-10(12)6-4-3-5-7-11/h2-9H2,1H3 |
| InChIKey | FGWGBNADIWWHLL-UHFFFAOYSA-N |
| Molecular Weight | 222.712 g/mol |
| SMILES | C(CCCCl)CC(=O)OCCOCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.810094 |