| SpectraBase Compound ID | 5MZV8CmR14S |
|---|---|
| InChI | InChI=1S/C14H26O2/c1-5-12(3)8-7-9-13(4)10-11-14(15)16-6-2/h12H,4-11H2,1-3H3 |
| InChIKey | LELDZPSBETUGAE-UHFFFAOYSA-N |
| Mol Weight | 226.36 g/mol |
| Molecular Formula | C14H26O2 |
| Exact Mass | 226.19328 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 2L6UK7i2VEw |
|---|---|
| Name | Ethyl 4-methylene-8-methyldecanoate |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 226.193280075 u |
| Formula | C14H26O2 |
| InChI | InChI=1S/C14H26O2/c1-5-12(3)8-7-9-13(4)10-11-14(15)16-6-2/h12H,4-11H2,1-3H3 |
| InChIKey | LELDZPSBETUGAE-UHFFFAOYSA-N |
| Molecular Weight | 226.360 g/mol |
| SMILES | C(CCC(CCCC(CC)C)=C)(=O)OCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.988968 |