| SpectraBase Compound ID | IJMnuujNSQB |
|---|---|
| InChI | InChI=1S/C14H22O4/c1-3-17-13(15)12(14(16)18-4-2)10-11-8-6-5-7-9-11/h10-11H,3-9H2,1-2H3 |
| InChIKey | OHKVDTBSKOGHMM-UHFFFAOYSA-N |
| Mol Weight | 254.33 g/mol |
| Molecular Formula | C14H22O4 |
| Exact Mass | 254.151809 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CCiFVC9lHgg |
|---|---|
| Name | 2-(Cyclohexylmethylene)malonic acid diethyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 254.151809184 u |
| Formula | C14H22O4 |
| InChI | InChI=1S/C14H22O4/c1-3-17-13(15)12(14(16)18-4-2)10-11-8-6-5-7-9-11/h10-11H,3-9H2,1-2H3 |
| InChIKey | OHKVDTBSKOGHMM-UHFFFAOYSA-N |
| Molecular Weight | 254.326 g/mol |
| SMILES | C(=C(C(=O)OCC)C(=O)OCC)C1CCCCC1 |