| SpectraBase Compound ID | HYWs3FuxTJy |
|---|---|
| InChI | InChI=1S/C13H24O5/c1-3-4-9-17-12(14)7-5-6-8-13(15)18-11-10-16-2/h3-11H2,1-2H3 |
| InChIKey | RUHZNQRCRLIZQJ-UHFFFAOYSA-N |
| Mol Weight | 260.33 g/mol |
| Molecular Formula | C13H24O5 |
| Exact Mass | 260.162374 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | F1w5pYDBLJH |
|---|---|
| Name | Adipic acid, butyl 2-methoxyethyl ester |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 260.162373868 u |
| Formula | C13H24O5 |
| InChI | InChI=1S/C13H24O5/c1-3-4-9-17-12(14)7-5-6-8-13(15)18-11-10-16-2/h3-11H2,1-2H3 |
| InChIKey | RUHZNQRCRLIZQJ-UHFFFAOYSA-N |
| Molecular Weight | 260.330 g/mol |
| SMILES | C(CCCC(=O)OCCOC)C(OCCCC)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.947577 |