| SpectraBase Compound ID | LMK6L9COVvO |
|---|---|
| InChI | InChI=1S/C20H34O4/c1-4-6-10-17(5-2)14-23-19(21)12-13-20(22)24-15-18-11-8-7-9-16(18)3/h17H,4-15H2,1-3H3 |
| InChIKey | HCZTZWNTDLIZQI-UHFFFAOYSA-N |
| Mol Weight | 338.5 g/mol |
| Molecular Formula | C20H34O4 |
| Exact Mass | 338.24571 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | E8cigGinIG2 |
|---|---|
| Name | Succinic acid, 2-ethylhexyl (2-methylcyclohex-1-en-1-yl)methyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 338.245709571 u |
| Formula | C20H34O4 |
| InChI | InChI=1S/C20H34O4/c1-4-6-10-17(5-2)14-23-19(21)12-13-20(22)24-15-18-11-8-7-9-16(18)3/h17H,4-15H2,1-3H3 |
| InChIKey | HCZTZWNTDLIZQI-UHFFFAOYSA-N |
| Molecular Weight | 338.488 g/mol |
| SMILES | C(CC(OCC(CC)CCCC)=O)C(OCC1=C(C)CCCC1)=O |