| SpectraBase Compound ID | 50NEFe5pQU1 |
|---|---|
| InChI | InChI=1S/C11H20O4/c1-13-10(12)8-6-4-5-7-9-11(14-2)15-3/h4-5,11H,6-9H2,1-3H3 |
| InChIKey | HCSZWGHWZNDBSA-UHFFFAOYSA-N |
| Mol Weight | 216.28 g/mol |
| Molecular Formula | C11H20O4 |
| Exact Mass | 216.136159 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 | 9032SGYzkxX |
|---|---|
| Name | 8,8-Dimethoxy-4-octenoic acid, methyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 216.136159120 u |
| Formula | C11H20O4 |
| InChI | InChI=1S/C11H20O4/c1-13-10(12)8-6-4-5-7-9-11(14-2)15-3/h4-5,11H,6-9H2,1-3H3 |
| InChIKey | HCSZWGHWZNDBSA-UHFFFAOYSA-N |
| Molecular Weight | 216.277 g/mol |
| SMILES | COC(CCC=CCCC(OC)=O)OC |