| SpectraBase Compound ID | 9CLSVU1KTZC |
|---|---|
| InChI | InChI=1S/C8H12O6/c9-3-4-13-5-6-14-8(12)2-1-7(10)11/h3H,1-2,4-6H2,(H,10,11) |
| InChIKey | ZSXXSWUHRWCYQG-UHFFFAOYSA-N |
| Mol Weight | 204.18 g/mol |
| Molecular Formula | C8H12O6 |
| Exact Mass | 204.063388 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 2LcJ9FmUEJu |
|---|---|
| Name | Succinate - ethoxyacetaldehyde |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 204.063388100 u |
| Formula | C8H12O6 |
| InChI | InChI=1S/C8H12O6/c9-3-4-13-5-6-14-8(12)2-1-7(10)11/h3H,1-2,4-6H2,(H,10,11) |
| InChIKey | ZSXXSWUHRWCYQG-UHFFFAOYSA-N |
| Molecular Weight | 204.178 g/mol |
| SMILES | C(O)(=O)CCC(OCCOCC=O)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.980558 |