| SpectraBase Compound ID | FMEWnCs5ZEl |
|---|---|
| InChI | InChI=1S/C24H38O4/c1-5-6-7-8-9-12-19-27-22(25)13-10-11-14-23(26)28-21-17-15-20(16-18-21)24(2,3)4/h15-18H,5-14,19H2,1-4H3 |
| InChIKey | TYECTYRPHJAXJY-UHFFFAOYSA-N |
| Mol Weight | 390.6 g/mol |
| Molecular Formula | C24H38O4 |
| Exact Mass | 390.27701 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | gbOmUcJcHF |
|---|---|
| Name | Adipic acid, octyl 4-tert-butylphenyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 390.277009700 u |
| Formula | C24H38O4 |
| InChI | InChI=1S/C24H38O4/c1-5-6-7-8-9-12-19-27-22(25)13-10-11-14-23(26)28-21-17-15-20(16-18-21)24(2,3)4/h15-18H,5-14,19H2,1-4H3 |
| InChIKey | TYECTYRPHJAXJY-UHFFFAOYSA-N |
| Molecular Weight | 390.564 g/mol |
| SMILES | C(C(=O)OC1=CC=C(C=C1)C(C)(C)C)CCCC(OCCCCCCCC)=O |