| SpectraBase Compound ID | 3V5Espg9hBz |
|---|---|
| InChI | InChI=1S/C24H37IO4/c1-2-3-4-5-6-7-8-9-10-11-19-28-23(26)13-12-14-24(27)29-20-21-15-17-22(25)18-16-21/h15-18H,2-14,19-20H2,1H3 |
| InChIKey | CSAVWGZWVXRJRG-UHFFFAOYSA-N |
| Mol Weight | 516.5 g/mol |
| Molecular Formula | C24H37IO4 |
| Exact Mass | 516.173655 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DFVtU8mFHrv |
|---|---|
| Name | Glutaric acid, dodecyl 4-iodobenzyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 516.173654667 u |
| Formula | C24H37IO4 |
| InChI | InChI=1S/C24H37IO4/c1-2-3-4-5-6-7-8-9-10-11-19-28-23(26)13-12-14-24(27)29-20-21-15-17-22(25)18-16-21/h15-18H,2-14,19-20H2,1H3 |
| InChIKey | CSAVWGZWVXRJRG-UHFFFAOYSA-N |
| Molecular Weight | 516.460 g/mol |
| SMILES | C(OCC=1C=CC(=CC1)I)(=O)CCCC(OCCCCCCCCCCCC)=O |