| SpectraBase Compound ID | 4rKTVg3M2fN |
|---|---|
| InChI | InChI=1S/C20H32O2/c1-2-3-4-5-6-7-8-12-18-22-20(21)17-13-16-19-14-10-9-11-15-19/h9-11,14-15H,2-8,12-13,16-18H2,1H3 |
| InChIKey | MHAGXQZGTXYSMN-UHFFFAOYSA-N |
| Mol Weight | 304.5 g/mol |
| Molecular Formula | C20H32O2 |
| Exact Mass | 304.24023 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7IDtovWbhOC |
|---|---|
| Name | Butyric acid, 4-phenyl-, decyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 304.240230268 u |
| Formula | C20H32O2 |
| InChI | InChI=1S/C20H32O2/c1-2-3-4-5-6-7-8-12-18-22-20(21)17-13-16-19-14-10-9-11-15-19/h9-11,14-15H,2-8,12-13,16-18H2,1H3 |
| InChIKey | MHAGXQZGTXYSMN-UHFFFAOYSA-N |
| Molecular Weight | 304.474 g/mol |
| SMILES | C(CCCC=1C=CC=CC1)(OCCCCCCCCCC)=O |