| SpectraBase Compound ID | IsrMI6fAXm |
|---|---|
| InChI | InChI=1S/C16H12ClFO4/c17-11-5-1-3-7-13(11)21-15(19)9-10-16(20)22-14-8-4-2-6-12(14)18/h1-8H,9-10H2 |
| InChIKey | OQWPZCHJHDUMPG-UHFFFAOYSA-N |
| Mol Weight | 322.72 g/mol |
| Molecular Formula | C16H12ClFO4 |
| Exact Mass | 322.040815 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | FoF8HcA6aY0 |
|---|---|
| Name | Succinic acid, 2-fluorophenyl 2-chlorophenyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 322.040814725 u |
| Formula | C16H12ClFO4 |
| InChI | InChI=1S/C16H12ClFO4/c17-11-5-1-3-7-13(11)21-15(19)9-10-16(20)22-14-8-4-2-6-12(14)18/h1-8H,9-10H2 |
| InChIKey | OQWPZCHJHDUMPG-UHFFFAOYSA-N |
| Molecular Weight | 322.719 g/mol |
| SMILES | C(CC(OC1=CC=CC=C1F)=O)C(OC=1C=CC=CC1Cl)=O |