| SpectraBase Compound ID | DH6491TWmoT |
|---|---|
| InChI | InChI=1S/C8H16O3/c1-8(2)5-10-7(3-4-9)11-6-8/h7,9H,3-6H2,1-2H3 |
| InChIKey | HYGOOWUTSBFURW-UHFFFAOYSA-N |
| Mol Weight | 160.21 g/mol |
| Molecular Formula | C8H16O3 |
| Exact Mass | 160.109944 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | DI3x4FvLpgH |
|---|---|
| Name | 5,5-Dimethyl-1,3-dioxane-2-ethanol |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 160.109944372 u |
| Formula | C8H16O3 |
| InChI | InChI=1S/C8H16O3/c1-8(2)5-10-7(3-4-9)11-6-8/h7,9H,3-6H2,1-2H3 |
| InChIKey | HYGOOWUTSBFURW-UHFFFAOYSA-N |
| Molecular Weight | 160.213 g/mol |
| SMILES | CC1(COC(OC1)CCO)C |
| Spectrum/Structure Validation Score (Raman) | 0.991722 |