| SpectraBase Compound ID | IufAzOseFo0 |
|---|---|
| InChI | InChI=1S/C8H14O2/c1-8(7-10)5-3-2-4-6-9/h6-8H,2-5H2,1H3 |
| InChIKey | CEWCLVWWMXFUQL-UHFFFAOYSA-N |
| Mol Weight | 142.2 g/mol |
| Molecular Formula | C8H14O2 |
| Exact Mass | 142.09938 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3pFXZk2q85a |
|---|---|
| Name | 2-Methylheptanedial |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 142.099379689 u |
| Formula | C8H14O2 |
| InChI | InChI=1S/C8H14O2/c1-8(7-10)5-3-2-4-6-9/h6-8H,2-5H2,1H3 |
| InChIKey | CEWCLVWWMXFUQL-UHFFFAOYSA-N |
| Molecular Weight | 142.198 g/mol |
| SMILES | C(C(CCCCC=O)C)=O |