| SpectraBase Compound ID | DJL8l52KyuY |
|---|---|
| InChI | InChI=1S/C12H18O2/c1-5-10(2)9-11(3)7-6-8-12(13)14-4/h5H,1-3,6-9H2,4H3 |
| InChIKey | AFXAPLFCJRMOJW-UHFFFAOYSA-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 | 1z8j0brwzqa |
|---|---|
| Name | 8-Nonenoic acid, 5,7-dimethylene-, methyl ester |
| 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/c1-5-10(2)9-11(3)7-6-8-12(13)14-4/h5H,1-3,6-9H2,4H3 |
| InChIKey | AFXAPLFCJRMOJW-UHFFFAOYSA-N |
| Molecular Weight | 194.274 g/mol |
| SMILES | C=C(C=C)CC(=C)CCCC(=O)OC |