| SpectraBase Compound ID | AjVZrpXOx2O |
|---|---|
| InChI | InChI=1S/C12H20O2/c1-4-14-11-6-5-10(7-9(2)3)12(13)8-11/h8-10H,4-7H2,1-3H3 |
| InChIKey | VLVZOBLLQVRDIM-UHFFFAOYSA-N |
| Mol Weight | 196.29 g/mol |
| Molecular Formula | C12H20O2 |
| Exact Mass | 196.14633 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CAc2nBTwYwi |
|---|---|
| Name | 3-Ethoxy-6-(2-methylpropyl)-1-cyclohex-2-enone |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 196.146329882 u |
| Formula | C12H20O2 |
| InChI | InChI=1S/C12H20O2/c1-4-14-11-6-5-10(7-9(2)3)12(13)8-11/h8-10H,4-7H2,1-3H3 |
| InChIKey | VLVZOBLLQVRDIM-UHFFFAOYSA-N |
| Molecular Weight | 196.290 g/mol |
| SMILES | C=1C(C(CC(C)C)CCC1OCC)=O |