| SpectraBase Compound ID | 58gjKhUMqH7 |
|---|---|
| InChI | InChI=1S/C9H18O4/c1-7(5-11-4)12-6-8(2)13-9(3)10/h7-8H,5-6H2,1-4H3 |
| InChIKey | LAVARTIQQDZFNT-UHFFFAOYSA-N |
| Mol Weight | 190.24 g/mol |
| Molecular Formula | C9H18O4 |
| Exact Mass | 190.120509 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | GIPU4nWGc9D |
|---|---|
| Name | 1-(1-Methoxypropan-2-yloxy)propan-2-yl acetate |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 190.120509056 u |
| Formula | C9H18O4 |
| InChI | InChI=1S/C9H18O4/c1-7(5-11-4)12-6-8(2)13-9(3)10/h7-8H,5-6H2,1-4H3 |
| InChIKey | LAVARTIQQDZFNT-UHFFFAOYSA-N |
| Molecular Weight | 190.239 g/mol |
| SMILES | COCC(OCC(OC(C)=O)C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.951868 |