| SpectraBase Compound ID | JJlOkoxO4K4 |
|---|---|
| InChI | InChI=1S/C20H30O4/c1-3-4-5-6-7-8-9-10-13-16-24-20(22)18-15-12-11-14-17(18)19(21)23-2/h11-12,14-15H,3-10,13,16H2,1-2H3 |
| InChIKey | JVRIDSPDECQZNO-UHFFFAOYSA-N |
| Mol Weight | 334.46 g/mol |
| Molecular Formula | C20H30O4 |
| Exact Mass | 334.214409 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6vSJE25Kn7x |
|---|---|
| Name | Methyl undecyl phthalate |
| 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/c1-3-4-5-6-7-8-9-10-13-16-24-20(22)18-15-12-11-14-17(18)19(21)23-2/h11-12,14-15H,3-10,13,16H2,1-2H3 |
| InChIKey | JVRIDSPDECQZNO-UHFFFAOYSA-N |
| Molecular Weight | 334.456 g/mol |
| SMILES | C1=CC=CC(=C1C(=O)OCCCCCCCCCCC)C(=O)OC |