| SpectraBase Compound ID | 1o1GFY2bIdn |
|---|---|
| InChI | InChI=1S/C20H30O4/c1-5-6-7-8-15-23-18(21)13-14-19(22)24-17-11-9-16(10-12-17)20(2,3)4/h9-12H,5-8,13-15H2,1-4H3 |
| InChIKey | SHKZIJQDWBSDBT-UHFFFAOYSA-N |
| Mol Weight | 334.46 g/mol |
| Molecular Formula | C20H30O4 |
| Exact Mass | 334.214409 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 | Q69VLt61Y8 |
|---|---|
| Name | Succinic acid, hexyl 4-tert-butylphenyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 334.214409442 u |
| Formula | C20H30O4 |
| InChI | InChI=1S/C20H30O4/c1-5-6-7-8-15-23-18(21)13-14-19(22)24-17-11-9-16(10-12-17)20(2,3)4/h9-12H,5-8,13-15H2,1-4H3 |
| InChIKey | SHKZIJQDWBSDBT-UHFFFAOYSA-N |
| Molecular Weight | 334.456 g/mol |
| SMILES | C(CC(OC1=CC=C(C=C1)C(C)(C)C)=O)C(OCCCCCC)=O |