| SpectraBase Compound ID | Es6nm4O7lP8 |
|---|---|
| InChI | InChI=1S/C20H28O4/c1-2-3-4-5-6-9-15-23-19(21)17-13-7-8-14-18(17)20(22)24-16-11-10-12-16/h7-8,13-14,16H,2-6,9-12,15H2,1H3 |
| InChIKey | CVCAORRVQMGQDB-UHFFFAOYSA-N |
| Mol Weight | 332.44 g/mol |
| Molecular Formula | C20H28O4 |
| Exact Mass | 332.198759 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Gax8NwxI76D |
|---|---|
| Name | Phthalic acid, cyclobutyl octyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 332.198759378 u |
| Formula | C20H28O4 |
| InChI | InChI=1S/C20H28O4/c1-2-3-4-5-6-9-15-23-19(21)17-13-7-8-14-18(17)20(22)24-16-11-10-12-16/h7-8,13-14,16H,2-6,9-12,15H2,1H3 |
| InChIKey | CVCAORRVQMGQDB-UHFFFAOYSA-N |
| Molecular Weight | 332.440 g/mol |
| SMILES | C1(CCC1)OC(=O)C1=C(C=CC=C1)C(=O)OCCCCCCCC |