| SpectraBase Compound ID | 7I2DjvGuCr |
|---|---|
| InChI | InChI=1S/C9H14O2/c1-3-5-9(11)7-6-8(10)4-2/h6-7H,3-5H2,1-2H3/b7-6+ |
| InChIKey | IHPPWHBXWMGRRS-VOTSOKGWSA-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 | LOyMnKqK9y7 |
|---|---|
| Name | 1-Propanoyl-2-(butanoyl)ethylene |
| 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/c1-3-5-9(11)7-6-8(10)4-2/h6-7H,3-5H2,1-2H3/b7-6+ |
| InChIKey | IHPPWHBXWMGRRS-VOTSOKGWSA-N |
| Molecular Weight | 154.209 g/mol |
| SMILES | C(\C=C\C(CC)=O)(CCC)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.814651 |