| SpectraBase Compound ID | FbXhc3jXDb5 |
|---|---|
| InChI | InChI=1S/C14H26O2/c1-14(13(15)16-2)11-9-7-5-3-4-6-8-10-12-14/h3-12H2,1-2H3 |
| InChIKey | DELNPIAJTUNHSR-UHFFFAOYSA-N |
| Mol Weight | 226.36 g/mol |
| Molecular Formula | C14H26O2 |
| Exact Mass | 226.19328 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | EJps48uWG9o |
|---|---|
| Name | Cycloundecanecarboxylic acid, 1-methyl-, methyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 226.193280075 u |
| Formula | C14H26O2 |
| InChI | InChI=1S/C14H26O2/c1-14(13(15)16-2)11-9-7-5-3-4-6-8-10-12-14/h3-12H2,1-2H3 |
| InChIKey | DELNPIAJTUNHSR-UHFFFAOYSA-N |
| Molecular Weight | 226.360 g/mol |
| SMILES | C1CCCC(CCCCCC1)(C)C(=O)OC |