| SpectraBase Compound ID | 3F5smA1tmSK |
|---|---|
| InChI | InChI=1S/C20H32O2/c1-22-20(21)18-14-9-7-5-3-2-4-6-8-11-15-19-16-12-10-13-17-19/h10,12-13,16-17H,2-9,11,14-15,18H2,1H3 |
| InChIKey | JWVDZXNFGDETQE-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 | AZPYmmERNM0 |
|---|---|
| Name | Methyl 13-phenyl-tridecanoate |
| 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/c1-22-20(21)18-14-9-7-5-3-2-4-6-8-11-15-19-16-12-10-13-17-19/h10,12-13,16-17H,2-9,11,14-15,18H2,1H3 |
| InChIKey | JWVDZXNFGDETQE-UHFFFAOYSA-N |
| Molecular Weight | 304.474 g/mol |
| SMILES | C1(=CC=CC=C1)CCCCCCCCCCCCC(=O)OC |