| SpectraBase Compound ID | AIyan1poKg |
|---|---|
| InChI | InChI=1S/C11H16O3/c1-7(12)11(8(2)13)9-4-3-5-10(14)6-9/h9,11H,3-6H2,1-2H3 |
| InChIKey | IVRZXZRBXXAQBP-UHFFFAOYSA-N |
| Mol Weight | 196.25 g/mol |
| Molecular Formula | C11H16O3 |
| Exact Mass | 196.109944 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 3H1AJfktsMw |
|---|---|
| Name | 3-(3-Oxocyclohexyl)pentan-2,4-dione |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C11H16O3 |
| InChI | InChI=1S/C11H16O3/c1-7(12)11(8(2)13)9-4-3-5-10(14)6-9/h9,11H,3-6H2,1-2H3 |
| InChIKey | IVRZXZRBXXAQBP-UHFFFAOYSA-N |
| Instrument Name | GCMS |
| Ionization Type | EI |
| Molecular Weight | 196.246 g/mol |
| SMILES | CC(C(C(C)=O)C1CC(CCC1)=O)=O |
| SPLASH | splash10-0007-9300000000-8bf2d18073c93b2ba749 |
| Source of Spectrum | WO2017045745A1 |
| Wiley ID | 1872435 |