| SpectraBase Compound ID | 9CeqfdEcTIN |
|---|---|
| InChI | InChI=1S/C12H22O2/c1-2-3-4-5-6-7-8-10-9-11(10)12(13)14/h10-11H,2-9H2,1H3,(H,13,14) |
| InChIKey | FLZRNGWKTVAXBN-UHFFFAOYSA-N |
| Mol Weight | 198.31 g/mol |
| Molecular Formula | C12H22O2 |
| Exact Mass | 198.16198 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9R7UbNITpsO |
|---|---|
| Name | 2-Octylcyclopropane-1-carboxylic acid |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 198.161979946 u |
| Formula | C12H22O2 |
| InChI | InChI=1S/C12H22O2/c1-2-3-4-5-6-7-8-10-9-11(10)12(13)14/h10-11H,2-9H2,1H3,(H,13,14) |
| InChIKey | FLZRNGWKTVAXBN-UHFFFAOYSA-N |
| Molecular Weight | 198.306 g/mol |
| SMILES | C(CCC)CCCCC1C(C(O)=O)C1 |