| SpectraBase Compound ID | 4dINE4H2cfy |
|---|---|
| InChI | InChI=1S/C12H18O2/c1-2-3-4-5-6-7-8-11-9-10-12(13)14-11/h5-8,11H,2-4,9-10H2,1H3/b6-5-,8-7+ |
| InChIKey | YKYMPMBSZXDDQN-IGTJQSIKSA-N |
| Mol Weight | 194.27 g/mol |
| Molecular Formula | C12H18O2 |
| Exact Mass | 194.13068 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | CNKOOKuB9z |
|---|---|
| Name | .Gamma.-dodecadienolactone (Z-Z or E-Z) |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 194.130679818 u |
| Formula | C12H18O2 |
| InChI | InChI=1S/C12H18O2/c1-2-3-4-5-6-7-8-11-9-10-12(13)14-11/h5-8,11H,2-4,9-10H2,1H3/b6-5-,8-7+ |
| InChIKey | YKYMPMBSZXDDQN-IGTJQSIKSA-N |
| Molecular Weight | 194.274 g/mol |
| SMILES | C1(OC(\C=C\C=C/CCCC)CC1)=O |