| SpectraBase Compound ID | 9IjBryIuF7Y |
|---|---|
| InChI | InChI=1S/C16H28O/c1-3-5-7-8-9-10-11-13-15-16(17)14-12-6-4-2/h10-11,13,15H,3-9,12,14H2,1-2H3/b11-10+,15-13+ |
| InChIKey | FPYDPPKABIBHGC-KZTCSYITSA-N |
| Mol Weight | 236.4 g/mol |
| Molecular Formula | C16H28O |
| Exact Mass | 236.214016 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | HX7BXPABbhr |
|---|---|
| Name | (7E,9E)-6-oxo-7,9-Hexadecadiene |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 236.214015521 u |
| Formula | C16H28O |
| InChI | InChI=1S/C16H28O/c1-3-5-7-8-9-10-11-13-15-16(17)14-12-6-4-2/h10-11,13,15H,3-9,12,14H2,1-2H3/b11-10+,15-13+ |
| InChIKey | FPYDPPKABIBHGC-KZTCSYITSA-N |
| Molecular Weight | 236.399 g/mol |
| SMILES | C(\C=C\C=C\C(=O)CCCCC)CCCCC |