| SpectraBase Compound ID | Ehd5Xuly0yj |
|---|---|
| InChI | InChI=1S/C20H30O4/c1-6-7-10-13-23-18(21)16-11-8-9-12-17(16)19(22)24-15(2)14-20(3,4)5/h8-9,11-12,15H,6-7,10,13-14H2,1-5H3 |
| InChIKey | GAJQAOKZPAIZLU-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 | 7ocxtF4eqQI |
|---|---|
| Name | Phthalic acid, 4,4-dimethylpent-2-yl pentyl ester |
| 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/c1-6-7-10-13-23-18(21)16-11-8-9-12-17(16)19(22)24-15(2)14-20(3,4)5/h8-9,11-12,15H,6-7,10,13-14H2,1-5H3 |
| InChIKey | GAJQAOKZPAIZLU-UHFFFAOYSA-N |
| Molecular Weight | 334.456 g/mol |
| SMILES | C1=CC=CC(=C1C(OCCCCC)=O)C(OC(C)CC(C)(C)C)=O |