| SpectraBase Compound ID | ARUsSGi6t99 |
|---|---|
| InChI | InChI=1S/C18H32O4/c1-4-7-9-10-14-21-17(19)12-13-18(20)22-15-16(6-3)11-8-5-2/h9-10,16H,4-8,11-15H2,1-3H3/b10-9- |
| InChIKey | QYZAODBWVPGAMB-KTKRTIGZSA-N |
| Mol Weight | 312.5 g/mol |
| Molecular Formula | C18H32O4 |
| Exact Mass | 312.23006 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | HjLy3hJNxUl |
|---|---|
| Name | Succinic acid, 2-ethylhexyl cis-hex-2-en-1-yl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 312.230059506 u |
| Formula | C18H32O4 |
| InChI | InChI=1S/C18H32O4/c1-4-7-9-10-14-21-17(19)12-13-18(20)22-15-16(6-3)11-8-5-2/h9-10,16H,4-8,11-15H2,1-3H3/b10-9- |
| InChIKey | QYZAODBWVPGAMB-KTKRTIGZSA-N |
| Molecular Weight | 312.450 g/mol |
| SMILES | C(CC(OCC(CC)CCCC)=O)C(OC\C=C/CCC)=O |