| SpectraBase Compound ID | I6ID00eL6qv |
|---|---|
| InChI | InChI=1S/C24H46O/c1-4-7-10-13-15-18-21-24(23-25,20-17-12-9-6-3)22-19-16-14-11-8-5-2/h18,21,23H,4-17,19-20,22H2,1-3H3/b21-18+ |
| InChIKey | WWJUPSORZVYLAI-DYTRJAOYSA-N |
| Mol Weight | 350.6 g/mol |
| Molecular Formula | C24H46O |
| Exact Mass | 350.354866 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2ScmWwyEWer |
|---|---|
| Name | 2-Octyl-2-hexyl-3-decenal |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 350.354866100 u |
| Formula | C24H46O |
| InChI | InChI=1S/C24H46O/c1-4-7-10-13-15-18-21-24(23-25,20-17-12-9-6-3)22-19-16-14-11-8-5-2/h18,21,23H,4-17,19-20,22H2,1-3H3/b21-18+ |
| InChIKey | WWJUPSORZVYLAI-DYTRJAOYSA-N |
| Molecular Weight | 350.631 g/mol |
| SMILES | C(\C=C\CCCCCC)(C=O)(CCCCCC)CCCCCCCC |