| SpectraBase Compound ID | Cj9NQ0Pk4WS |
|---|---|
| InChI | InChI=1S/C18H34O4/c1-7-9-10-15(8-2)13-21-16(19)11-12-17(20)22-14(3)18(4,5)6/h14-15H,7-13H2,1-6H3 |
| InChIKey | YECRBVRBWNBKBV-UHFFFAOYSA-N |
| Mol Weight | 314.5 g/mol |
| Molecular Formula | C18H34O4 |
| Exact Mass | 314.24571 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 8ncuwu2aLzz |
|---|---|
| Name | Succinic acid, 2-ethylhexyl 3,3-dimethylbut-2-yl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 314.245709571 u |
| Formula | C18H34O4 |
| InChI | InChI=1S/C18H34O4/c1-7-9-10-15(8-2)13-21-16(19)11-12-17(20)22-14(3)18(4,5)6/h14-15H,7-13H2,1-6H3 |
| InChIKey | YECRBVRBWNBKBV-UHFFFAOYSA-N |
| SMILES | C(CC(OCC(CC)CCCC)=O)C(OC(C(C)(C)C)C)=O |