| SpectraBase Compound ID | 9xRcuRnocl |
|---|---|
| InChI | InChI=1S/C9H16O3/c1-4-5-9(6-7(2)10)12-8(3)11/h9H,4-6H2,1-3H3 |
| InChIKey | MQWZYBABOBIQSD-UHFFFAOYSA-N |
| Mol Weight | 172.22 g/mol |
| Molecular Formula | C9H16O3 |
| Exact Mass | 172.109944 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 9RPJ4lSlHwa |
|---|---|
| Name | 4-Acetoxyheptan-2-one |
| Alternate Name(s) | 3-Oxo-1-propylbutyl acetate |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C9H16O3 |
| InChI | InChI=1S/C9H16O3/c1-4-5-9(6-7(2)10)12-8(3)11/h9H,4-6H2,1-3H3 |
| InChIKey | MQWZYBABOBIQSD-UHFFFAOYSA-N |
| Molecular Weight | 172.224 g/mol |
| SMILES | CC(CC(CCC)OC(=O)C)=O |
| SPLASH | splash10-0006-9100000000-def40961c0492f2bfc86 |
| Source of Spectrum | H-87-774-13 |
| Wiley ID | 1563665 |