| SpectraBase Compound ID | JdN5dlUshJD |
|---|---|
| InChI | InChI=1S/C13H22O3/c1-2-3-4-9-13-12(15)8-6-5-7-11(14)10-16-13/h13H,2-10H2,1H3 |
| InChIKey | JJDJQBUADDEVAI-UHFFFAOYSA-N |
| Mol Weight | 226.32 g/mol |
| Molecular Formula | C13H22O3 |
| Exact Mass | 226.156895 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 9Skwr1TBdI3 |
|---|---|
| Name | 2-Pentyloxonane-3,8-dione |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C13H22O3 |
| InChI | InChI=1S/C13H22O3/c1-2-3-4-9-13-12(15)8-6-5-7-11(14)10-16-13/h13H,2-10H2,1H3 |
| InChIKey | JJDJQBUADDEVAI-UHFFFAOYSA-N |
| Molecular Weight | 226.316 g/mol |
| SMILES | C1(OCC(CCCCC1=O)=O)CCCCC |
| SPLASH | splash10-001i-9100000000-2c2379d843e07afff69e |
| Source of Spectrum | KC-0-1142-12 |
| Synonyms | 2-Pentyl-3,8-oxonanedione |
| Wiley ID | 783770 |