| SpectraBase Compound ID | Kt3wHpHTbRD |
|---|---|
| InChI | InChI=1S/C15H19FO4/c1-2-3-10-19-14(17)8-5-9-15(18)20-13-7-4-6-12(16)11-13/h4,6-7,11H,2-3,5,8-10H2,1H3 |
| InChIKey | LMQTVBZKWBVZCB-UHFFFAOYSA-N |
| Mol Weight | 282.31 g/mol |
| Molecular Formula | C15H19FO4 |
| Exact Mass | 282.126737 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 29Je0AB2CmY |
|---|---|
| Name | Glutaric acid, butyl 3-fluorophenyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 282.126737251 u |
| Formula | C15H19FO4 |
| InChI | InChI=1S/C15H19FO4/c1-2-3-10-19-14(17)8-5-9-15(18)20-13-7-4-6-12(16)11-13/h4,6-7,11H,2-3,5,8-10H2,1H3 |
| InChIKey | LMQTVBZKWBVZCB-UHFFFAOYSA-N |
| Molecular Weight | 282.311 g/mol |
| SMILES | CCCCOC(CCCC(OC1=CC=CC(=C1)F)=O)=O |