| SpectraBase Compound ID | K5wXaJjWtfy |
|---|---|
| InChI | InChI=1S/C12H22O3/c1-4-5-6-7-8-9-11(10(2)13)12(14)15-3/h11H,4-9H2,1-3H3 |
| InChIKey | CWUSXSYQJSNZAL-UHFFFAOYSA-N |
| Mol Weight | 214.3 g/mol |
| Molecular Formula | C12H22O3 |
| Exact Mass | 214.156895 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 3VPHfFjuhn6 |
|---|---|
| Name | Methyl 2-acetylnonanoate |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C12H22O3 |
| InChI | InChI=1S/C12H22O3/c1-4-5-6-7-8-9-11(10(2)13)12(14)15-3/h11H,4-9H2,1-3H3 |
| InChIKey | CWUSXSYQJSNZAL-UHFFFAOYSA-N |
| Literature Reference DOI | 10.1002/pca.2466 |
| Molecular Weight | 214.305 g/mol |
| SMILES | CC(C(CCCCCCC)C(OC)=O)=O |
| SPLASH | splash10-014u-8900000000-c4b8b12ebbf5b544cafe |
| Source of Spectrum | PA-25-75/SM2-3a |
| Wiley ID | 1787685 |