| SpectraBase Compound ID | Cxs96pVIHtU |
|---|---|
| InChI | InChI=1S/C9H16O6/c1-4-12-8(10)14-6-7(3)15-9(11)13-5-2/h7H,4-6H2,1-3H3 |
| InChIKey | NSLXRDJMYHNCHG-UHFFFAOYSA-N |
| Mol Weight | 220.22 g/mol |
| Molecular Formula | C9H16O6 |
| Exact Mass | 220.094688 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | Jigw8hf8c7W |
|---|---|
| Name | Diethyl propane-1,2-diyl dicarbonate |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 220.094688229 u |
| Formula | C9H16O6 |
| InChI | InChI=1S/C9H16O6/c1-4-12-8(10)14-6-7(3)15-9(11)13-5-2/h7H,4-6H2,1-3H3 |
| InChIKey | NSLXRDJMYHNCHG-UHFFFAOYSA-N |
| Molecular Weight | 220.221 g/mol |
| SMILES | C(=O)(OCC)OCC(C)OC(=O)OCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.965344 |