| SpectraBase Compound ID | 9YePXCAjyOE |
|---|---|
| InChI | InChI=1S/C9H16O/c1-4-6-7-8-9(5-2)10-3/h4-5,9H,1-2,6-8H2,3H3 |
| InChIKey | XURMIWYINDMTRH-UHFFFAOYSA-N |
| Mol Weight | 140.23 g/mol |
| Molecular Formula | C9H16O |
| Exact Mass | 140.120115 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 6439PhHykhz |
|---|---|
| Name | 3-Methoxy-1,7-octadiene |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 140.120115134 u |
| Formula | C9H16O |
| InChI | InChI=1S/C9H16O/c1-4-6-7-8-9(5-2)10-3/h4-5,9H,1-2,6-8H2,3H3 |
| InChIKey | XURMIWYINDMTRH-UHFFFAOYSA-N |
| Molecular Weight | 140.226 g/mol |
| SMILES | C(OC)(CCCC=C)C=C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.90117 |