| SpectraBase Compound ID | FftynSKOwvf |
|---|---|
| InChI | InChI=1S/C9H16O2/c1-7(9(10)11)8-5-3-2-4-6-8/h7-8H,2-6H2,1H3,(H,10,11) |
| InChIKey | VRLUSLNMNQAPOH-UHFFFAOYSA-N |
| Mol Weight | 156.22 g/mol |
| Molecular Formula | C9H16O2 |
| Exact Mass | 156.11503 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | FF029WBCloo |
|---|---|
| Name | 2-Cyclohexylpropanoic acid |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 156.115029753 u |
| Formula | C9H16O2 |
| InChI | InChI=1S/C9H16O2/c1-7(9(10)11)8-5-3-2-4-6-8/h7-8H,2-6H2,1H3,(H,10,11) |
| InChIKey | VRLUSLNMNQAPOH-UHFFFAOYSA-N |
| Molecular Weight | 156.225 g/mol |
| SMILES | C1C(CCCC1)C(C)C(O)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.928008 |