| SpectraBase Compound ID | 5ZmUvsOZWjd |
|---|---|
| InChI | InChI=1S/C20H32O3/c1-2-3-4-5-6-7-8-9-10-11-12-18-13-15-19(16-14-18)23-17-20(21)22/h13-16H,2-12,17H2,1H3,(H,21,22) |
| InChIKey | QJVZFCHAWMXXQS-UHFFFAOYSA-N |
| Mol Weight | 320.5 g/mol |
| Molecular Formula | C20H32O3 |
| Exact Mass | 320.235145 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Hu3rdYpfLAZ |
|---|---|
| Name | (p-Dodecylphenoxy)acetic acid |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 320.235144887 u |
| Formula | C20H32O3 |
| InChI | InChI=1S/C20H32O3/c1-2-3-4-5-6-7-8-9-10-11-12-18-13-15-19(16-14-18)23-17-20(21)22/h13-16H,2-12,17H2,1H3,(H,21,22) |
| InChIKey | QJVZFCHAWMXXQS-UHFFFAOYSA-N |
| Molecular Weight | 320.473 g/mol |
| SMILES | C1=C(C=CC(=C1)CCCCCCCCCCCC)OCC(O)=O |