| SpectraBase Compound ID | E10jNenD8Kb |
|---|---|
| InChI | InChI=1S/C14H22O/c1-11(10-15)7-8-13-12(2)6-5-9-14(13,3)4/h10,13H,1-2,5-9H2,3-4H3 |
| InChIKey | WOGYNENARNGEFU-UHFFFAOYSA-N |
| Mol Weight | 206.33 g/mol |
| Molecular Formula | C14H22O |
| Exact Mass | 206.167065 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DjpfIvPzilG |
|---|---|
| Name | Cyclohexanebutanal, 2,2-dimethyl-.alpha.,6-bis(methylene)-, (S)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 206.167065327 u |
| Formula | C14H22O |
| InChI | InChI=1S/C14H22O/c1-11(10-15)7-8-13-12(2)6-5-9-14(13,3)4/h10,13H,1-2,5-9H2,3-4H3 |
| InChIKey | WOGYNENARNGEFU-UHFFFAOYSA-N |
| Molecular Weight | 206.329 g/mol |
| SMILES | C1(C(=C)CCCC1(C)C)CCC(=C)C=O |