| SpectraBase Compound ID | 2YzNSUyHM79 |
|---|---|
| InChI | InChI=1S/C11H12ClFO2/c12-8-4-3-7-11(14)15-10-6-2-1-5-9(10)13/h1-2,5-6H,3-4,7-8H2 |
| InChIKey | KBNKOZFVQYABJR-UHFFFAOYSA-N |
| Mol Weight | 230.67 g/mol |
| Molecular Formula | C11H12ClFO2 |
| Exact Mass | 230.050985 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GzPKYQmtwy9 |
|---|---|
| Name | 5-Chlorovaleric acid, 2-fluorophenyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 230.050985487 u |
| Formula | C11H12ClFO2 |
| InChI | InChI=1S/C11H12ClFO2/c12-8-4-3-7-11(14)15-10-6-2-1-5-9(10)13/h1-2,5-6H,3-4,7-8H2 |
| InChIKey | KBNKOZFVQYABJR-UHFFFAOYSA-N |
| Molecular Weight | 230.666 g/mol |
| SMILES | C(CCl)CCC(OC1=CC=CC=C1F)=O |