| SpectraBase Compound ID | 2DMKDYEF0fR |
|---|---|
| InChI | InChI=1S/C15H19FO2/c1-10-7-11(2)9-12(8-10)18-15(17)13-5-3-4-6-14(13)16/h3-6,10-12H,7-9H2,1-2H3 |
| InChIKey | ZEZUOUJGVCPPQZ-UHFFFAOYSA-N |
| Mol Weight | 250.31 g/mol |
| Molecular Formula | C15H19FO2 |
| Exact Mass | 250.136908 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KNMEn1JWFTl |
|---|---|
| Name | 2-Fluorobenzoic acid, 3,5-dimethylcyclohexyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 250.136908013 u |
| Formula | C15H19FO2 |
| InChI | InChI=1S/C15H19FO2/c1-10-7-11(2)9-12(8-10)18-15(17)13-5-3-4-6-14(13)16/h3-6,10-12H,7-9H2,1-2H3 |
| InChIKey | ZEZUOUJGVCPPQZ-UHFFFAOYSA-N |
| Molecular Weight | 250.313 g/mol |
| SMILES | CC1CC(CC(C)C1)OC(=O)C1=C(F)C=CC=C1 |