| SpectraBase Compound ID | 30Sd0ar9aES |
|---|---|
| InChI | InChI=1S/C12H20O3/c1-3-15-12(14)9(2)11(13)10-7-5-4-6-8-10/h9-10H,3-8H2,1-2H3 |
| InChIKey | BLNDDOYRZJTDDW-UHFFFAOYSA-N |
| Mol Weight | 212.29 g/mol |
| Molecular Formula | C12H20O3 |
| Exact Mass | 212.141245 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | w542kD3zHH |
|---|---|
| Name | 3-Cyclohexyl-2-methyl-3-oxopropanoic acid ethyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 212.141244501 u |
| Formula | C12H20O3 |
| InChI | InChI=1S/C12H20O3/c1-3-15-12(14)9(2)11(13)10-7-5-4-6-8-10/h9-10H,3-8H2,1-2H3 |
| InChIKey | BLNDDOYRZJTDDW-UHFFFAOYSA-N |
| Molecular Weight | 212.289 g/mol |
| SMILES | C(C(=O)C1CCCCC1)(C(=O)OCC)C |