| SpectraBase Compound ID | 20dCo2nzjxG |
|---|---|
| InChI | InChI=1S/C12H18O2/c13-12-10-8-6-4-2-1-3-5-7-9-11-14-12/h1-2,6,8H,3-5,7,9-11H2/b2-1-,8-6- |
| InChIKey | IDCDKEUBOYQTFY-NGNAIVRQSA-N |
| Mol Weight | 194.27 g/mol |
| Molecular Formula | C12H18O2 |
| Exact Mass | 194.13068 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4tGmhluyFIx |
|---|---|
| Name | (4Z,7Z)-1-Oxacyclotrideca-4,7-dien-2-one |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 194.130679818 u |
| Formula | C12H18O2 |
| InChI | InChI=1S/C12H18O2/c13-12-10-8-6-4-2-1-3-5-7-9-11-14-12/h1-2,6,8H,3-5,7,9-11H2/b2-1-,8-6- |
| InChIKey | IDCDKEUBOYQTFY-NGNAIVRQSA-N |
| Molecular Weight | 194.274 g/mol |
| SMILES | C1(OCCCCC\C=C/C\C=C/C1)=O |