| SpectraBase Compound ID | 4wBa8ijihyo |
|---|---|
| InChI | InChI=1S/C18H34O2/c1-3-5-7-9-13-17(19)15-11-12-16-18(20)14-10-8-6-4-2/h3-16H2,1-2H3 |
| InChIKey | GTOXASPCFDYNOX-UHFFFAOYSA-N |
| Mol Weight | 282.5 g/mol |
| Molecular Formula | C18H34O2 |
| Exact Mass | 282.25588 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6c4rJBdlfw7 |
|---|---|
| Name | Octadecane-7,12-dione |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 282.255880333 u |
| Formula | C18H34O2 |
| InChI | InChI=1S/C18H34O2/c1-3-5-7-9-13-17(19)15-11-12-16-18(20)14-10-8-6-4-2/h3-16H2,1-2H3 |
| InChIKey | GTOXASPCFDYNOX-UHFFFAOYSA-N |
| Molecular Weight | 282.468 g/mol |
| SMILES | CCCCCCC(CCCCC(CCCCCC)=O)=O |