| SpectraBase Compound ID | LsNYm6BlbBH |
|---|---|
| InChI | InChI=1S/C16H26O/c1-5-16(10-7-13-17)12-11-15(4)9-6-8-14(2)3/h7-8,10-11,13,16H,5-6,9,12H2,1-4H3/b10-7+,15-11- |
| InChIKey | FKDMTOCPIDCTDG-XGQUATGFSA-N |
| Mol Weight | 234.38 g/mol |
| Molecular Formula | C16H26O |
| Exact Mass | 234.198365 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BFT3jFEdhZU |
|---|---|
| Name | 4-Ethyl-7,11-dimethyl-trans-2,cis-6,10-dodecatrienal |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 234.198365456 u |
| Formula | C16H26O |
| InChI | InChI=1S/C16H26O/c1-5-16(10-7-13-17)12-11-15(4)9-6-8-14(2)3/h7-8,10-11,13,16H,5-6,9,12H2,1-4H3/b10-7+,15-11- |
| InChIKey | FKDMTOCPIDCTDG-XGQUATGFSA-N |
| Molecular Weight | 234.383 g/mol |
| SMILES | C(\C=C\C(C\C=C/(CCC=C(C)C)C)CC)=O |