| SpectraBase Compound ID | LJ0MgxnHjss |
|---|---|
| InChI | InChI=1S/C12H20O4/c1-2-3-4-5-9-15-11(13)12(14)16-10-7-6-8-10/h10H,2-9H2,1H3 |
| InChIKey | ISRKRIARGCEOKQ-UHFFFAOYSA-N |
| Mol Weight | 228.29 g/mol |
| Molecular Formula | C12H20O4 |
| Exact Mass | 228.136159 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2UAx5bP0y0u |
|---|---|
| Name | Oxalic acid, cyclobutyl hexyl 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/c1-2-3-4-5-9-15-11(13)12(14)16-10-7-6-8-10/h10H,2-9H2,1H3 |
| InChIKey | ISRKRIARGCEOKQ-UHFFFAOYSA-N |
| Molecular Weight | 228.288 g/mol |
| SMILES | C(OC1CCC1)(C(OCCCCCC)=O)=O |