| SpectraBase Compound ID | 5bdrcYrQXcu |
|---|---|
| InChI | InChI=1S/C8H16O4/c1-3-9-7-8(10-4-2)12-6-5-11-7/h7-8H,3-6H2,1-2H3/t7-,8-/m0/s1 |
| InChIKey | VDIKXUVXTWMNQI-YUMQZZPRSA-N |
| Mol Weight | 176.21 g/mol |
| Molecular Formula | C8H16O4 |
| Exact Mass | 176.104859 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | H0Y3PPDj8zU |
|---|---|
| Name | 1,4-Dioxane, 2,3-diethoxy-, trans- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 176.104858991 u |
| Formula | C8H16O4 |
| InChI | InChI=1S/C8H16O4/c1-3-9-7-8(10-4-2)12-6-5-11-7/h7-8H,3-6H2,1-2H3/t7-,8-/m0/s1 |
| InChIKey | VDIKXUVXTWMNQI-YUMQZZPRSA-N |
| Molecular Weight | 176.212 g/mol |
| SMILES | [C@@]1([C@](OCCO1)(OCC)[H])(OCC)[H] |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.96685 |