| SpectraBase Compound ID | 9jenYUvZsew |
|---|---|
| InChI | InChI=1S/C13H20O4/c1-6-10(4)16-12(14)7-8-13(15)17-11(5)9(2)3/h1,9-11H,7-8H2,2-5H3 |
| InChIKey | JEWISMGVIZJBAG-UHFFFAOYSA-N |
| Mol Weight | 240.3 g/mol |
| Molecular Formula | C13H20O4 |
| Exact Mass | 240.136159 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | ujOqtQr17a |
|---|---|
| Name | Succinic acid, but-3-yn-2-yl 3-methylbut-2-yl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 240.136159120 u |
| Formula | C13H20O4 |
| InChI | InChI=1S/C13H20O4/c1-6-10(4)16-12(14)7-8-13(15)17-11(5)9(2)3/h1,9-11H,7-8H2,2-5H3 |
| InChIKey | JEWISMGVIZJBAG-UHFFFAOYSA-N |
| Molecular Weight | 240.299 g/mol |
| SMILES | C(CC(OC(C#C)C)=O)C(OC(C(C)C)C)=O |