| SpectraBase Compound ID | AZhnttdmlGX |
|---|---|
| InChI | InChI=1S/C12H20O4/c1-3-5-6-7-12(10(13)15-4-2)8-9-16-11(12)14/h3-9H2,1-2H3 |
| InChIKey | FGGVSXPCGULNAU-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 | LXy36h9nRDT |
|---|---|
| Name | 2-oxo-3-Pentyl-3-oxolanecarboxylic acid ethyl 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/c1-3-5-6-7-12(10(13)15-4-2)8-9-16-11(12)14/h3-9H2,1-2H3 |
| InChIKey | FGGVSXPCGULNAU-UHFFFAOYSA-N |
| Molecular Weight | 228.288 g/mol |
| SMILES | C1(C(OCC1)=O)(C(=O)OCC)CCCCC |