| SpectraBase Compound ID | CGrfvf9IL7 |
|---|---|
| InChI | InChI=1S/C9H16O3/c10-6-7-12-9(11)8-4-2-1-3-5-8/h8,10H,1-7H2 |
| InChIKey | HNBNKZUJQWPLIO-UHFFFAOYSA-N |
| Mol Weight | 172.22 g/mol |
| Molecular Formula | C9H16O3 |
| Exact Mass | 172.109944 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4kDIprjnuxF |
|---|---|
| Name | 2-Hydroxyethyl cyclohexanecarboxylate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 172.109944372 u |
| Formula | C9H16O3 |
| InChI | InChI=1S/C9H16O3/c10-6-7-12-9(11)8-4-2-1-3-5-8/h8,10H,1-7H2 |
| InChIKey | HNBNKZUJQWPLIO-UHFFFAOYSA-N |
| Molecular Weight | 172.224 g/mol |
| SMILES | C(=O)(C1CCCCC1)OCCO |