![Butanoic acid, 4-[(2-fluoro-5-nitrophenyl)amino]-4-oxo-, methyl ester](/api/spectrum/H6mUxTUIJem/structure.png?h=300&w=458 "Butanoic acid, 4-[(2-fluoro-5-nitrophenyl)amino]-4-oxo-, methyl ester")
| SpectraBase Compound ID | Ch3agDGlhze |
|---|---|
| InChI | InChI=1S/C11H11FN2O5/c1-19-11(16)5-4-10(15)13-9-6-7(14(17)18)2-3-8(9)12/h2-3,6H,4-5H2,1H3,(H,13,15) |
| InChIKey | LIHSLTZTQWHXTJ-UHFFFAOYSA-N |
| Mol Weight | 270.22 g/mol |
| Molecular Formula | C11H11FN2O5 |
| Exact Mass | 270.0652 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | H6mUxTUIJem |
|---|---|
| Name | Butanoic acid, 4-[(2-fluoro-5-nitrophenyl)amino]-4-oxo-, methyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 270.065199620 u |
| Formula | C11H11FN2O5 |
| InChI | InChI=1S/C11H11FN2O5/c1-19-11(16)5-4-10(15)13-9-6-7(14(17)18)2-3-8(9)12/h2-3,6H,4-5H2,1H3,(H,13,15) |
| InChIKey | LIHSLTZTQWHXTJ-UHFFFAOYSA-N |
| Molecular Weight | 270.216 g/mol |
| SMILES | COC(=O)CCC(=O)NC1=CC(=CC=C1F)N(=O)=O |