| SpectraBase Compound ID | I4FXkqboOND |
|---|---|
| InChI | InChI=1S/C11H19NO5/c1-5-17-10(14)9(8(2)13)6-7-11(3,4)12(15)16/h9H,5-7H2,1-4H3 |
| InChIKey | BXBDYXITHIDWGV-UHFFFAOYSA-N |
| Mol Weight | 245.27 g/mol |
| Molecular Formula | C11H19NO5 |
| Exact Mass | 245.126323 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | IvPdvXCuLx |
|---|---|
| Name | Ethyl 2-acetyl-5-methyl-5-nitrohexanoate |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C11H19NO5 |
| InChI | InChI=1S/C11H19NO5/c1-5-17-10(14)9(8(2)13)6-7-11(3,4)12(15)16/h9H,5-7H2,1-4H3 |
| InChIKey | BXBDYXITHIDWGV-UHFFFAOYSA-N |
| Molecular Weight | 245.275 g/mol |
| SMILES | C(N(=O)=O)(CCC(C(=O)OCC)C(=O)C)(C)C |
| SPLASH | splash10-014u-9100000000-eb2de300d1c45c874365 |
| Source of Spectrum | O-27-741-0 |
| Wiley ID | 1247841 |