| SpectraBase Compound ID | JqBpjFvGkIz |
|---|---|
| InChI | InChI=1S/C11H14O5/c1-2-15-11(14)7-8(12)6-9(13)10-4-3-5-16-10/h3-5,9,13H,2,6-7H2,1H3/t9-/m1/s1 |
| InChIKey | DWRPCJRIKQUWEF-SECBINFHSA-N |
| Mol Weight | 226.23 g/mol |
| Molecular Formula | C11H14O5 |
| Exact Mass | 226.084124 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 48n37fLQuSA |
|---|---|
| Name | (5R)-Ethyl .delta.-hydroxy-.delta.-(furan-2-yl)-.beta.-oxo-pentanoate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 226.084123546 u |
| Formula | C11H14O5 |
| InChI | InChI=1S/C11H14O5/c1-2-15-11(14)7-8(12)6-9(13)10-4-3-5-16-10/h3-5,9,13H,2,6-7H2,1H3/t9-/m1/s1 |
| InChIKey | DWRPCJRIKQUWEF-SECBINFHSA-N |
| Molecular Weight | 226.228 g/mol |
| SMILES | C=1([C@@](CC(CC(=O)OCC)=O)(O)[H])OC=CC1 |