| SpectraBase Compound ID | 10Y3mgn24Tx |
|---|---|
| InChI | InChI=1S/C11H20O3/c1-10(12)8-6-4-3-5-7-9-11(13)14-2/h3-9H2,1-2H3 |
| InChIKey | HBEFOKAECCZCNW-UHFFFAOYSA-N |
| Mol Weight | 200.28 g/mol |
| Molecular Formula | C11H20O3 |
| Exact Mass | 200.141245 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 66hw4h6lNs3 |
|---|---|
| Name | Methyl-9-oxo-decanoate |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 200.141244501 u |
| Formula | C11H20O3 |
| InChI | InChI=1S/C11H20O3/c1-10(12)8-6-4-3-5-7-9-11(13)14-2/h3-9H2,1-2H3 |
| InChIKey | HBEFOKAECCZCNW-UHFFFAOYSA-N |
| Molecular Weight | 200.278 g/mol |
| SMILES | C(=O)(OC)CCCCCCCC(=O)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.965564 |