| SpectraBase Compound ID | AgiZF6BW4M4 |
|---|---|
| InChI | InChI=1S/C24H30O4/c1-3-5-17-27-22(25)19-24(20-13-9-7-10-14-20,21-15-11-8-12-16-21)23(26)28-18-6-4-2/h7-16H,3-6,17-19H2,1-2H3 |
| InChIKey | IWADILXQTXRMAL-UHFFFAOYSA-N |
| Mol Weight | 382.5 g/mol |
| Molecular Formula | C24H30O4 |
| Exact Mass | 382.214409 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7jxUn2us4gA |
|---|---|
| Name | 2,2-Diphenylsuccinic acid, dibutyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 382.214409442 u |
| Formula | C24H30O4 |
| InChI | InChI=1S/C24H30O4/c1-3-5-17-27-22(25)19-24(20-13-9-7-10-14-20,21-15-11-8-12-16-21)23(26)28-18-6-4-2/h7-16H,3-6,17-19H2,1-2H3 |
| InChIKey | IWADILXQTXRMAL-UHFFFAOYSA-N |
| Molecular Weight | 382.500 g/mol |
| SMILES | C1=CC(=CC=C1)C(C1=CC=CC=C1)(CC(=O)OCCCC)C(=O)OCCCC |