| SpectraBase Compound ID | 3GIwYBIx6Eg |
|---|---|
| InChI | InChI=1S/C12H20O2/c1-3-5-7-9-11-14-12(13)10-8-6-4-2/h5-8H,3-4,9-11H2,1-2H3/b7-5-,8-6+ |
| InChIKey | UZJQQWFHPLYECS-CGXWXWIYSA-N |
| Mol Weight | 196.29 g/mol |
| Molecular Formula | C12H20O2 |
| Exact Mass | 196.14633 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | J90lorMVnsy |
|---|---|
| Name | Trans-3-hexenyl cis-3-hexenoate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 196.146329882 u |
| Formula | C12H20O2 |
| InChI | InChI=1S/C12H20O2/c1-3-5-7-9-11-14-12(13)10-8-6-4-2/h5-8H,3-4,9-11H2,1-2H3/b7-5-,8-6+ |
| InChIKey | UZJQQWFHPLYECS-CGXWXWIYSA-N |
| Molecular Weight | 196.290 g/mol |
| SMILES | C(C\C=C\CC)(=O)OCC\C=C/CC |