![2-{5-[2-(Acetyloxy)propyl]oxolan-2-yl}propanoic acid](/api/spectrum/G68uI40BcA/structure.png?h=300&w=458 "2-{5-[2-(Acetyloxy)propyl]oxolan-2-yl}propanoic acid")
| SpectraBase Compound ID | 4ZhOtnWGMJa |
|---|---|
| InChI | InChI=1S/C12H20O5/c1-7(16-9(3)13)6-10-4-5-11(17-10)8(2)12(14)15/h7-8,10-11H,4-6H2,1-3H3,(H,14,15) |
| InChIKey | UNALYPZXDXSXSO-UHFFFAOYSA-N |
| Mol Weight | 244.29 g/mol |
| Molecular Formula | C12H20O5 |
| Exact Mass | 244.131074 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | G68uI40BcA |
|---|---|
| Name | 2-{5-[2-(Acetyloxy)propyl]oxolan-2-yl}propanoic acid |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 244.131073739 u |
| Formula | C12H20O5 |
| InChI | InChI=1S/C12H20O5/c1-7(16-9(3)13)6-10-4-5-11(17-10)8(2)12(14)15/h7-8,10-11H,4-6H2,1-3H3,(H,14,15) |
| InChIKey | UNALYPZXDXSXSO-UHFFFAOYSA-N |
| Molecular Weight | 244.287 g/mol |
| SMILES | C(C1OC(CC(OC(=O)C)C)CC1)(C(=O)O)C |