| SpectraBase Compound ID | 2wmV5ViCWtv |
|---|---|
| InChI | InChI=1S/C12H20O4/c1-9(2)5-4-8-15-11(13)12(14)16-10-6-3-7-10/h9-10H,3-8H2,1-2H3 |
| InChIKey | VXLLBKCGGJMCIG-UHFFFAOYSA-N |
| Mol Weight | 228.29 g/mol |
| Molecular Formula | C12H20O4 |
| Exact Mass | 228.136159 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 | 5vPmHa3FEIp |
|---|---|
| Name | Oxalic acid, cyclobutyl isohexyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 228.136159120 u |
| Formula | C12H20O4 |
| InChI | InChI=1S/C12H20O4/c1-9(2)5-4-8-15-11(13)12(14)16-10-6-3-7-10/h9-10H,3-8H2,1-2H3 |
| InChIKey | VXLLBKCGGJMCIG-UHFFFAOYSA-N |
| Molecular Weight | 228.288 g/mol |
| SMILES | C(C(OC1CCC1)=O)(OCCCC(C)C)=O |