| SpectraBase Compound ID | Bq4dQCTeGhB |
|---|---|
| InChI | InChI=1S/C12H20O3/c1-4-7-8-11(6-3)10-15-12(13)14-9-5-2/h2,11H,4,6-10H2,1,3H3 |
| InChIKey | QOJFGFLSHWRPKO-UHFFFAOYSA-N |
| Mol Weight | 212.29 g/mol |
| Molecular Formula | C12H20O3 |
| Exact Mass | 212.141245 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 | 4JglLWJqHuV |
|---|---|
| Name | Carbonic acid, propargyl 2-ethylhexyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 212.141244501 u |
| Formula | C12H20O3 |
| InChI | InChI=1S/C12H20O3/c1-4-7-8-11(6-3)10-15-12(13)14-9-5-2/h2,11H,4,6-10H2,1,3H3 |
| InChIKey | QOJFGFLSHWRPKO-UHFFFAOYSA-N |
| Molecular Weight | 212.289 g/mol |
| SMILES | C(COC(=O)OCC(CC)CCCC)#C |