| SpectraBase Compound ID | HUfWPQqmfLn |
|---|---|
| InChI | InChI=1S/C20H30O4/c1-4-6-7-8-9-10-11-12-13-14-17-23-19(21)15-16-20(22)24-18(3)5-2/h2,18H,4,8-17H2,1,3H3 |
| InChIKey | LPIYQZYMNORFCL-UHFFFAOYSA-N |
| Mol Weight | 334.46 g/mol |
| Molecular Formula | C20H30O4 |
| Exact Mass | 334.214409 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | UP2R9RrfuW |
|---|---|
| Name | Succinic acid, but-3-yn-2-yl dodec-9-yn-1-yl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 334.214409442 u |
| Formula | C20H30O4 |
| InChI | InChI=1S/C20H30O4/c1-4-6-7-8-9-10-11-12-13-14-17-23-19(21)15-16-20(22)24-18(3)5-2/h2,18H,4,8-17H2,1,3H3 |
| InChIKey | LPIYQZYMNORFCL-UHFFFAOYSA-N |
| Molecular Weight | 334.456 g/mol |
| SMILES | C(CC(OC(C#C)C)=O)C(OCCCCCCCCC#CCC)=O |