| SpectraBase Compound ID | KNSyDvfa2Gw |
|---|---|
| InChI | InChI=1S/C9H14O/c10-8-4-7-9-5-2-1-3-6-9/h5,8H,1-4,6-7H2 |
| InChIKey | JCJMLAMVTOLKIU-UHFFFAOYSA-N |
| Mol Weight | 138.21 g/mol |
| Molecular Formula | C9H14O |
| Exact Mass | 138.104465 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | FpDNn3sx8pA |
|---|---|
| Name | 3-(1-Cyclohexenyl)propanal |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 138.104465070 u |
| Formula | C9H14O |
| InChI | InChI=1S/C9H14O/c10-8-4-7-9-5-2-1-3-6-9/h5,8H,1-4,6-7H2 |
| InChIKey | JCJMLAMVTOLKIU-UHFFFAOYSA-N |
| Molecular Weight | 138.210 g/mol |
| SMILES | C1(=CCCCC1)CCC=O |