| SpectraBase Compound ID | 3JPUz0UI8li |
|---|---|
| InChI | InChI=1S/C17H26O2/c1-3-4-5-6-7-9-12-15(2)19-17(18)16-13-10-8-11-14-16/h8,10-11,13-15H,3-7,9,12H2,1-2H3 |
| InChIKey | WPQGCBLKSNYZOU-UHFFFAOYSA-N |
| Mol Weight | 262.39 g/mol |
| Molecular Formula | C17H26O2 |
| Exact Mass | 262.19328 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JTQyMo1sbQ7 |
|---|---|
| Name | Benzoic acid, dec-2-yl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 262.193280075 u |
| Formula | C17H26O2 |
| InChI | InChI=1S/C17H26O2/c1-3-4-5-6-7-9-12-15(2)19-17(18)16-13-10-8-11-14-16/h8,10-11,13-15H,3-7,9,12H2,1-2H3 |
| InChIKey | WPQGCBLKSNYZOU-UHFFFAOYSA-N |
| Molecular Weight | 262.393 g/mol |
| SMILES | C1=C(C=CC=C1)C(=O)OC(C)CCCCCCCC |