| SpectraBase Compound ID | 1NsRO5HPARz |
|---|---|
| InChI | InChI=1S/C10H20O4/c1-5-12-9(4)14-8(3)7-10(11)13-6-2/h8-9H,5-7H2,1-4H3 |
| InChIKey | SKONVJRTOGEDRD-UHFFFAOYSA-N |
| Mol Weight | 204.27 g/mol |
| Molecular Formula | C10H20O4 |
| Exact Mass | 204.136159 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 6XDoxy3xlr |
|---|---|
| Name | 3-(1-Ethoxyethoxy)butyric acid, ethyl ester |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 204.136159120 u |
| Formula | C10H20O4 |
| InChI | InChI=1S/C10H20O4/c1-5-12-9(4)14-8(3)7-10(11)13-6-2/h8-9H,5-7H2,1-4H3 |
| InChIKey | SKONVJRTOGEDRD-UHFFFAOYSA-N |
| Molecular Weight | 204.266 g/mol |
| SMILES | CCOC(OC(CC(OCC)=O)C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.977151 |