| SpectraBase Compound ID | LsWoxlusOPo |
|---|---|
| InChI | InChI=1S/C12H22O3/c1-2-3-4-5-6-7-12(8-9-13)14-10-11-15-12/h9H,2-8,10-11H2,1H3 |
| InChIKey | VNABDZWROQKFGF-UHFFFAOYSA-N |
| Mol Weight | 214.3 g/mol |
| Molecular Formula | C12H22O3 |
| Exact Mass | 214.156895 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 3ifEGUnHGMp |
|---|---|
| Name | 3,3-(Ethylenedioxy)decanal |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 214.156894565 u |
| Formula | C12H22O3 |
| InChI | InChI=1S/C12H22O3/c1-2-3-4-5-6-7-12(8-9-13)14-10-11-15-12/h9H,2-8,10-11H2,1H3 |
| InChIKey | VNABDZWROQKFGF-UHFFFAOYSA-N |
| Molecular Weight | 214.305 g/mol |
| SMILES | C1(CC=O)(OCCO1)CCCCCCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.826867 |