| SpectraBase Compound ID | LZ3mXwFGhod |
|---|---|
| InChI | InChI=1S/C10H16O2/c1-3-4-5-6-7-8-9-12-10(2)11/h5-8H,3-4,9H2,1-2H3/b6-5+,8-7+ |
| InChIKey | YAXSGIATFVJGNN-BSWSSELBSA-N |
| Mol Weight | 168.24 g/mol |
| Molecular Formula | C10H16O2 |
| Exact Mass | 168.11503 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | E2hZ3wGYnFm |
|---|---|
| Name | Trans, trans-octa-2,4-dienyl acetate |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 168.115029753 u |
| Formula | C10H16O2 |
| InChI | InChI=1S/C10H16O2/c1-3-4-5-6-7-8-9-12-10(2)11/h5-8H,3-4,9H2,1-2H3/b6-5+,8-7+ |
| InChIKey | YAXSGIATFVJGNN-BSWSSELBSA-N |
| Molecular Weight | 168.236 g/mol |
| SMILES | CCC\C=C\C=C\COC(C)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.953432 |