| SpectraBase Compound ID | 8zb5cowoM0a |
|---|---|
| InChI | InChI=1S/C11H20O2/c1-9(8-13-10(2)12)11-6-4-3-5-7-11/h9,11H,3-8H2,1-2H3 |
| InChIKey | LULRTPAMTBJUJC-UHFFFAOYSA-N |
| Mol Weight | 184.28 g/mol |
| Molecular Formula | C11H20O2 |
| Exact Mass | 184.14633 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | AiUholwzKGt |
|---|---|
| Name | Cyclohexaneethanol, beta-methyl-, acetate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 184.146329882 u |
| Formula | C11H20O2 |
| InChI | InChI=1S/C11H20O2/c1-9(8-13-10(2)12)11-6-4-3-5-7-11/h9,11H,3-8H2,1-2H3 |
| InChIKey | LULRTPAMTBJUJC-UHFFFAOYSA-N |
| Molecular Weight | 184.279 g/mol |
| SMILES | C1C(CCCC1)C(COC(C)=O)C |