| SpectraBase Compound ID | 510s6GjBs3d |
|---|---|
| InChI | InChI=1S/C9H16O2/c1-2-3-4-6-9(11)7-5-8-10/h8H,2-7H2,1H3 |
| InChIKey | MGOKSQNXXRPCMD-UHFFFAOYSA-N |
| Mol Weight | 156.22 g/mol |
| Molecular Formula | C9H16O2 |
| Exact Mass | 156.11503 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8Uz4vA86rCW |
|---|---|
| Name | 4-Oxononanal |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 156.115029753 u |
| Formula | C9H16O2 |
| InChI | InChI=1S/C9H16O2/c1-2-3-4-6-9(11)7-5-8-10/h8H,2-7H2,1H3 |
| InChIKey | MGOKSQNXXRPCMD-UHFFFAOYSA-N |
| Molecular Weight | 156.225 g/mol |
| SMILES | CCCCCC(CCC=O)=O |