| SpectraBase Compound ID | 8q09DKDqJqo |
|---|---|
| InChI | InChI=1S/C9H14O2/c1-3-5-6-7-8-9(10)11-4-2/h3,5-6H,1,4,7-8H2,2H3/b6-5+ |
| InChIKey | XUAMCTUAMASMMX-AATRIKPKSA-N |
| Mol Weight | 154.21 g/mol |
| Molecular Formula | C9H14O2 |
| Exact Mass | 154.09938 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | JL95wv8tOnA |
|---|---|
| Name | (E,E)-Ethyl_Hepta-4,6-dienoate |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 154.099379689 u |
| Formula | C9H14O2 |
| InChI | InChI=1S/C9H14O2/c1-3-5-6-7-8-9(10)11-4-2/h3,5-6H,1,4,7-8H2,2H3/b6-5+ |
| InChIKey | XUAMCTUAMASMMX-AATRIKPKSA-N |
| Molecular Weight | 154.209 g/mol |
| SMILES | C(=O)(CC\C=C\C=C)OCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.988736 |