| SpectraBase Compound ID | 9InbVubA3sF |
|---|---|
| InChI | InChI=1S/C20H24O2/c1-3-5-16-7-9-18(10-8-16)15-22-20(21)19-13-11-17(6-4-2)12-14-19/h7-14H,3-6,15H2,1-2H3 |
| InChIKey | IXYOEZDSVQPZEB-UHFFFAOYSA-N |
| Mol Weight | 296.41 g/mol |
| Molecular Formula | C20H24O2 |
| Exact Mass | 296.17763 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KxgsnJZbOti |
|---|---|
| Name | (4-Propylphenyl)methyl-4-propylbenzoate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 296.177630011 u |
| Formula | C20H24O2 |
| InChI | InChI=1S/C20H24O2/c1-3-5-16-7-9-18(10-8-16)15-22-20(21)19-13-11-17(6-4-2)12-14-19/h7-14H,3-6,15H2,1-2H3 |
| InChIKey | IXYOEZDSVQPZEB-UHFFFAOYSA-N |
| SMILES | C=1(C(OCC=2C=CC(=CC2)CCC)=O)C=CC(=CC1)CCC |