| SpectraBase Compound ID | DhZqtdanDtT |
|---|---|
| InChI | InChI=1S/C17H14ClFO4/c1-11-10-12(18)6-7-14(11)22-16(20)8-9-17(21)23-15-5-3-2-4-13(15)19/h2-7,10H,8-9H2,1H3 |
| InChIKey | KWRWERQIADSMGB-UHFFFAOYSA-N |
| Mol Weight | 336.75 g/mol |
| Molecular Formula | C17H14ClFO4 |
| Exact Mass | 336.056465 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BhuWk2K9f6C |
|---|---|
| Name | Succinic acid, 2-fluorophenyl 4-chloro-2-methylphenyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 336.056464790 u |
| Formula | C17H14ClFO4 |
| InChI | InChI=1S/C17H14ClFO4/c1-11-10-12(18)6-7-14(11)22-16(20)8-9-17(21)23-15-5-3-2-4-13(15)19/h2-7,10H,8-9H2,1H3 |
| InChIKey | KWRWERQIADSMGB-UHFFFAOYSA-N |
| Molecular Weight | 336.746 g/mol |
| SMILES | C(CC(OC1=CC=CC=C1F)=O)C(OC1=CC=C(C=C1C)Cl)=O |