| SpectraBase Compound ID | 2g85G9Dye2x |
|---|---|
| InChI | InChI=1S/C8H16O3/c1-4-5-10-6-7(2)11-8(3)9/h7H,4-6H2,1-3H3 |
| InChIKey | DMFAHCVITRDZQB-UHFFFAOYSA-N |
| Mol Weight | 160.21 g/mol |
| Molecular Formula | C8H16O3 |
| Exact Mass | 160.109944 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 3EAxQrRCcHH |
|---|---|
| Name | 1-Propoxypropan-2-yl acetate |
| 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/c1-4-5-10-6-7(2)11-8(3)9/h7H,4-6H2,1-3H3 |
| InChIKey | DMFAHCVITRDZQB-UHFFFAOYSA-N |
| Molecular Weight | 160.213 g/mol |
| SMILES | C(C)(COCCC)OC(C)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.97987 |