| SpectraBase Compound ID | 3LMh19HVipQ |
|---|---|
| InChI | InChI=1S/C12H22O2/c1-3-4-5-6-7-12(10-13)9-8-11(2)14/h10,12H,3-9H2,1-2H3 |
| InChIKey | ARZIBISEQQWLGT-UHFFFAOYSA-N |
| Mol Weight | 198.31 g/mol |
| Molecular Formula | C12H22O2 |
| Exact Mass | 198.16198 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | Km1LRpsWpRc |
|---|---|
| Name | 2-(3-Oxobutyl)octanal |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C12H22O2 |
| InChI | InChI=1S/C12H22O2/c1-3-4-5-6-7-12(10-13)9-8-11(2)14/h10,12H,3-9H2,1-2H3 |
| InChIKey | ARZIBISEQQWLGT-UHFFFAOYSA-N |
| Molecular Weight | 198.306 g/mol |
| SMILES | C(C(CCCCCC)CCC(C)=O)=O |
| SPLASH | splash10-052f-9100000000-345dce95fc0bda635b3c |
| Source of Spectrum | K-2001-319-10 |
| Wiley ID | 1578576 |