| SpectraBase Compound ID | 928G4zsOh1w |
|---|---|
| InChI | InChI=1S/C8H16O3/c1-2-4-10-8-3-5-9-6-7-11-8/h8H,2-7H2,1H3 |
| InChIKey | ZRMGWFDQSJUCKT-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 | Dxsox7y1cmi |
|---|---|
| Name | 5-Propoxy-1,4-dioxepane |
| 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/c1-2-4-10-8-3-5-9-6-7-11-8/h8H,2-7H2,1H3 |
| InChIKey | ZRMGWFDQSJUCKT-UHFFFAOYSA-N |
| Molecular Weight | 160.213 g/mol |
| SMILES | C1OCCC(OC1)OCCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.988595 |