| SpectraBase Compound ID | DDsXLxupDY6 |
|---|---|
| InChI | InChI=1S/C16H22O3/c1-3-12-6-4-5-7-15(12)19-16(17)13-8-10-14(18-2)11-9-13/h8-12,15H,3-7H2,1-2H3 |
| InChIKey | FDRVDBUZSGYCQT-UHFFFAOYSA-N |
| Mol Weight | 262.35 g/mol |
| Molecular Formula | C16H22O3 |
| Exact Mass | 262.156895 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7S2ScGtM5wm |
|---|---|
| Name | 4-Methoxybenzoic acid, 2-ethylcyclohexyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 262.156894565 u |
| Formula | C16H22O3 |
| InChI | InChI=1S/C16H22O3/c1-3-12-6-4-5-7-15(12)19-16(17)13-8-10-14(18-2)11-9-13/h8-12,15H,3-7H2,1-2H3 |
| InChIKey | FDRVDBUZSGYCQT-UHFFFAOYSA-N |
| Molecular Weight | 262.349 g/mol |
| SMILES | C1(OC(C2=CC=C(C=C2)OC)=O)C(CCCC1)CC |