| SpectraBase Compound ID | 7EnRIHcwMq2 |
|---|---|
| InChI | InChI=1S/C12H14O2/c1-3-5-6-7-8-9-10-11-12(13)14-4-2/h6-11H,4H2,1-2H3/b7-6+,9-8+,11-10+ |
| InChIKey | KKPDICZHAROGCS-OBWVEWQSSA-N |
| Mol Weight | 190.24 g/mol |
| Molecular Formula | C12H14O2 |
| Exact Mass | 190.09938 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | FwqkmQ9cidb |
|---|---|
| Name | Ethyl 2,4,6-decatrien-8-ynoate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 190.099379689 u |
| Formula | C12H14O2 |
| InChI | InChI=1S/C12H14O2/c1-3-5-6-7-8-9-10-11-12(13)14-4-2/h6-11H,4H2,1-2H3/b7-6+,9-8+,11-10+ |
| InChIKey | KKPDICZHAROGCS-OBWVEWQSSA-N |
| Molecular Weight | 190.242 g/mol |
| SMILES | C(#CC)\C=C\C=C\C=C\C(=O)OCC |