| SpectraBase Compound ID | 9CVpE78qbtg |
|---|---|
| InChI | InChI=1S/C12H22O3/c1-4-7-11(10(3)13)8-6-9-12(14)15-5-2/h11H,4-9H2,1-3H3 |
| InChIKey | NJMUNIJBIVFQOP-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 | DRl87K7bJx3 |
|---|---|
| Name | Ethyl 6-oxo-5-propylheptanoate |
| Alternate Name(s) | Ethyl 5-acetyloctanoate |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C12H22O3 |
| InChI | InChI=1S/C12H22O3/c1-4-7-11(10(3)13)8-6-9-12(14)15-5-2/h11H,4-9H2,1-3H3 |
| InChIKey | NJMUNIJBIVFQOP-UHFFFAOYSA-N |
| Molecular Weight | 214.305 g/mol |
| SMILES | C(=O)(OCC)CCCC(C(=O)C)CCC |
| SPLASH | splash10-0006-9100000000-789cf4b1d49804bdf188 |
| Source of Spectrum | J-57-5436-7 |
| Wiley ID | 1213652 |