| SpectraBase Compound ID | DtbdtFq0swh |
|---|---|
| InChI | InChI=1S/C10H20O3/c1-5-7-9(11)10(12-3,13-4)8-6-2/h5-8H2,1-4H3 |
| InChIKey | RRDQUQCCZKAPSS-UHFFFAOYSA-N |
| Mol Weight | 188.27 g/mol |
| Molecular Formula | C10H20O3 |
| Exact Mass | 188.141245 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 4qy7ITcrd2H |
|---|---|
| Name | 5,5-Dimethoxy-4-octanone |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 188.141244501 u |
| Formula | C10H20O3 |
| InChI | InChI=1S/C10H20O3/c1-5-7-9(11)10(12-3,13-4)8-6-2/h5-8H2,1-4H3 |
| InChIKey | RRDQUQCCZKAPSS-UHFFFAOYSA-N |
| Molecular Weight | 188.267 g/mol |
| SMILES | C(C(=O)CCC)(OC)(OC)CCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.86405 |