| SpectraBase Compound ID | FbLgFP1pUzf |
|---|---|
| InChI | InChI=1S/C14H13ClO2/c15-9-3-6-14(16)17-13-8-7-11-4-1-2-5-12(11)10-13/h1-2,4-5,7-8,10H,3,6,9H2 |
| InChIKey | KNSGPNGISXLZHO-UHFFFAOYSA-N |
| Mol Weight | 248.71 g/mol |
| Molecular Formula | C14H13ClO2 |
| Exact Mass | 248.060407 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7dtDPljfud7 |
|---|---|
| Name | 4-Chlorobutyric acid, 2-naphthyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 248.060407357 u |
| Formula | C14H13ClO2 |
| InChI | InChI=1S/C14H13ClO2/c15-9-3-6-14(16)17-13-8-7-11-4-1-2-5-12(11)10-13/h1-2,4-5,7-8,10H,3,6,9H2 |
| InChIKey | KNSGPNGISXLZHO-UHFFFAOYSA-N |
| Molecular Weight | 248.709 g/mol |
| SMILES | C1=CC2=CC=C(OC(CCCCl)=O)C=C2C=C1 |