| SpectraBase Compound ID | 3uYixjBGr7l |
|---|---|
| InChI | InChI=1S/C18H30O4/c1-5-7-8-9-10-11-12-16(4)22-18(20)14-13-17(19)21-15(3)6-2/h2,15-16H,5,7-14H2,1,3-4H3 |
| InChIKey | ABCHCHAFEPXTRS-UHFFFAOYSA-N |
| Mol Weight | 310.43 g/mol |
| Molecular Formula | C18H30O4 |
| Exact Mass | 310.214409 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2lvUTCspkVx |
|---|---|
| Name | Succinic acid, but-3-yn-2-yl 2-decyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 310.214409442 u |
| Formula | C18H30O4 |
| InChI | InChI=1S/C18H30O4/c1-5-7-8-9-10-11-12-16(4)22-18(20)14-13-17(19)21-15(3)6-2/h2,15-16H,5,7-14H2,1,3-4H3 |
| InChIKey | ABCHCHAFEPXTRS-UHFFFAOYSA-N |
| SMILES | C(CC(OC(C#C)C)=O)C(OC(CCCCCCCC)C)=O |