| SpectraBase Compound ID | 9McZrWvCDvG |
|---|---|
| InChI | InChI=1S/C19H30O4/c1-6-7-8-13-22-18(20)11-12-19(21)23-17(14-16(4)5)10-9-15(2)3/h16-17H,2,6-8,11-14H2,1,3-5H3 |
| InChIKey | DTIDSCRCJYCJNZ-UHFFFAOYSA-N |
| Mol Weight | 322.45 g/mol |
| Molecular Formula | C19H30O4 |
| Exact Mass | 322.214409 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | HWgXu8nRPob |
|---|---|
| Name | Succinic acid, 2,7-dimethyloctnon-5-yn-7-en-4-yl pentyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 322.214409442 u |
| Formula | C19H30O4 |
| InChI | InChI=1S/C19H30O4/c1-6-7-8-13-22-18(20)11-12-19(21)23-17(14-16(4)5)10-9-15(2)3/h16-17H,2,6-8,11-14H2,1,3-5H3 |
| InChIKey | DTIDSCRCJYCJNZ-UHFFFAOYSA-N |
| Molecular Weight | 322.445 g/mol |
| SMILES | CCCCCOC(CCC(OC(C#CC(=C)C)CC(C)C)=O)=O |