| SpectraBase Compound ID | FetEM0KoO0v |
|---|---|
| InChI | InChI=1S/C16H14FNO3/c1-2-21-16(20)12-7-5-6-11(10-12)15(19)18-14-9-4-3-8-13(14)17/h3-10H,2H2,1H3,(H,18,19) |
| InChIKey | WIGWYQSJFXWMOC-UHFFFAOYSA-N |
| Mol Weight | 287.29 g/mol |
| Molecular Formula | C16H14FNO3 |
| Exact Mass | 287.095771 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JeAydMkFJKD |
|---|---|
| Name | Isophthalic acid, monoamide, N-(2-fluorophenyl)-, ethyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 287.095771475 u |
| Formula | C16H14FNO3 |
| InChI | InChI=1S/C16H14FNO3/c1-2-21-16(20)12-7-5-6-11(10-12)15(19)18-14-9-4-3-8-13(14)17/h3-10H,2H2,1H3,(H,18,19) |
| InChIKey | WIGWYQSJFXWMOC-UHFFFAOYSA-N |
| Molecular Weight | 287.290 g/mol |
| SMILES | C(C1=CC(=CC=C1)C(OCC)=O)(NC1=C(C=CC=C1)F)=O |