| SpectraBase Compound ID | 1uAXYFmuYHV |
|---|---|
| InChI | InChI=1S/C19H32O4/c1-5-9-12-16(8-4)15-22-18(20)13-14-19(21)23-17(10-6-2)11-7-3/h6-7,16-17H,2-3,5,8-15H2,1,4H3 |
| InChIKey | IMRMLXJWKJDPGY-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 | 4jpAYbZg3NE |
|---|---|
| Name | Succinic acid, 2-ethylhexyl hept-1,6-dien-4-yl 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/c1-5-9-12-16(8-4)15-22-18(20)13-14-19(21)23-17(10-6-2)11-7-3/h6-7,16-17H,2-3,5,8-15H2,1,4H3 |
| InChIKey | IMRMLXJWKJDPGY-UHFFFAOYSA-N |
| Molecular Weight | 324.461 g/mol |
| SMILES | C(CC(OCC(CC)CCCC)=O)C(OC(CC=C)CC=C)=O |