| SpectraBase Compound ID | FhpZBqslpj2 |
|---|---|
| InChI | InChI=1S/C18H32O4/c1-14(2)7-6-8-16(5)11-12-21-17(19)9-10-18(20)22-13-15(3)4/h7,15-16H,6,8-13H2,1-5H3 |
| InChIKey | CWXJIOXASAIOON-UHFFFAOYSA-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 | EHTnNKF6PxI |
|---|---|
| Name | Succinic acid, 3,7-dimethyloct-6-en-1-yl isobutyl 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/c1-14(2)7-6-8-16(5)11-12-21-17(19)9-10-18(20)22-13-15(3)4/h7,15-16H,6,8-13H2,1-5H3 |
| InChIKey | CWXJIOXASAIOON-UHFFFAOYSA-N |
| Molecular Weight | 312.450 g/mol |
| SMILES | CC(C)=CCCC(C)CCOC(CCC(OCC(C)C)=O)=O |