| SpectraBase Compound ID | Bak71wgcen1 |
|---|---|
| InChI | InChI=1S/C12H14O4/c1-3-9-15-11(13)7-5-6-8-12(14)16-10-4-2/h1-2H,5-10H2 |
| InChIKey | UUKXRCZQOHIIPD-UHFFFAOYSA-N |
| Mol Weight | 222.24 g/mol |
| Molecular Formula | C12H14O4 |
| Exact Mass | 222.089209 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 | BDeeZxNol1E |
|---|---|
| Name | Adipic acid, dipropargyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 222.089208927 u |
| Formula | C12H14O4 |
| InChI | InChI=1S/C12H14O4/c1-3-9-15-11(13)7-5-6-8-12(14)16-10-4-2/h1-2H,5-10H2 |
| InChIKey | UUKXRCZQOHIIPD-UHFFFAOYSA-N |
| Molecular Weight | 222.240 g/mol |
| SMILES | C(CC(=O)OCC#C)CCC(OCC#C)=O |