| SpectraBase Compound ID | Ca22AAqRUlm |
|---|---|
| InChI | InChI=1S/C19H32O4/c1-5-7-8-9-10-11-13-17(4)23-19(21)15-12-14-18(20)22-16(3)6-2/h2,16-17H,5,7-15H2,1,3-4H3 |
| InChIKey | FOZBKTGOOZTXKM-UHFFFAOYSA-N |
| Mol Weight | 324.5 g/mol |
| Molecular Formula | C19H32O4 |
| Exact Mass | 324.23006 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9Sout4dyj2v |
|---|---|
| Name | Glutaric 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 | 324.230059506 u |
| Formula | C19H32O4 |
| InChI | InChI=1S/C19H32O4/c1-5-7-8-9-10-11-13-17(4)23-19(21)15-12-14-18(20)22-16(3)6-2/h2,16-17H,5,7-15H2,1,3-4H3 |
| InChIKey | FOZBKTGOOZTXKM-UHFFFAOYSA-N |
| Molecular Weight | 324.461 g/mol |
| SMILES | C(CCC(OC(C#C)C)=O)C(OC(CCCCCCCC)C)=O |