| SpectraBase Compound ID | CU5RlBfT5mA |
|---|---|
| InChI | InChI=1S/C18H22O3/c1-2-3-6-13-17(14-9-5-10-15-19)21-18(20)16-11-7-4-8-12-16/h4-5,7-12,14-15,17H,2-3,6,13H2,1H3/b10-5+,14-9+/t17-/m0/s1 |
| InChIKey | VYDCNNMUUZEFPR-IDXKTYHCSA-N |
| Mol Weight | 286.37 g/mol |
| Molecular Formula | C18H22O3 |
| Exact Mass | 286.156895 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | BkDj4DGcIDm |
|---|---|
| Name | (6S, 2E,4E)-6-Benzoyloxyundeca-2,4-dienal |
| Alternate Name(s) | (1S,2E,4E)-6-oxo-1-pentyl-2,4-hexadienyl benzoate benzoic acid[(1S,2E,4E)-1-amyl-6-keto-hexa-2,4-dienyl]ester benzoic acid[(2E,4E,6S)-1-oxoundeca-2,4-dien-6-yl]ester [(1S,2E,4E)-6-oxo-1-pentyl-hexa-2,4-dienyl]benzoate [(2E,4E,6S)-1-oxidanylideneundeca-2,4-dien-6-yl]benzoate [(2E,4E,6S)-1-oxoundeca-2,4-dien-6-yl]benzoate benzoic acid [(2E,4E,6S)-1-oxoundeca-2,4-dien-6-yl] ester [(2E,4E,6S)-1-oxoundeca-2,4-dien-6-yl] benzoate [(1S,2E,4E)-6-oxo-1-pentyl-hexa-2,4-dienyl] benzoate [(2E,4E,6S)-1-oxidanylideneundeca-2,4-dien-6-yl] benzoate |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C18H22O3 |
| InChI | InChI=1S/C18H22O3/c1-2-3-6-13-17(14-9-5-10-15-19)21-18(20)16-11-7-4-8-12-16/h4-5,7-12,14-15,17H,2-3,6,13H2,1H3/b10-5+,14-9+/t17-/m0/s1 |
| InChIKey | VYDCNNMUUZEFPR-IDXKTYHCSA-N |
| Molecular Weight | 286.371 g/mol |
| SMILES | C(O[C@](\C=C\C=C\C=O)(CCCCC)[H])(=O)c1ccccc1 |
| SPLASH | splash10-0a4i-1900000000-20a7878ed865c6947f7a |
| Source of Spectrum | KC-0-1061-3 |
| Wiley ID | 785516 |