| SpectraBase Compound ID | KK7wlWZQ98g |
|---|---|
| InChI | InChI=1S/C18H17FO4/c1-2-13-6-5-7-14(12-13)22-17(20)10-11-18(21)23-16-9-4-3-8-15(16)19/h3-9,12H,2,10-11H2,1H3 |
| InChIKey | MKBQFXYIRXNQGR-UHFFFAOYSA-N |
| Mol Weight | 316.33 g/mol |
| Molecular Formula | C18H17FO4 |
| Exact Mass | 316.111087 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Ff3XvLwpEAA |
|---|---|
| Name | Succinic acid, 2-fluorophenyl 3-ethylphenyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 316.111087186 u |
| Formula | C18H17FO4 |
| InChI | InChI=1S/C18H17FO4/c1-2-13-6-5-7-14(12-13)22-17(20)10-11-18(21)23-16-9-4-3-8-15(16)19/h3-9,12H,2,10-11H2,1H3 |
| InChIKey | MKBQFXYIRXNQGR-UHFFFAOYSA-N |
| Molecular Weight | 316.328 g/mol |
| SMILES | C(CC(OC1=CC=CC=C1F)=O)C(OC1=CC(=CC=C1)CC)=O |