| SpectraBase Compound ID | 7LJhOdx1XJT |
|---|---|
| InChI | InChI=1S/C13H14F5NO/c1-2-3-4-9-5-7-10(8-6-9)19-11(20)12(14,15)13(16,17)18/h5-8H,2-4H2,1H3,(H,19,20) |
| InChIKey | ZFNMZPTXWDXUDX-UHFFFAOYSA-N |
| Mol Weight | 295.25 g/mol |
| Molecular Formula | C13H14F5NO |
| Exact Mass | 295.099555 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6qa2mS2DC3t |
|---|---|
| Name | 4-Butylaniline, N-pentafluoropropionyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 295.099554889 u |
| Formula | C13H14F5NO |
| InChI | InChI=1S/C13H14F5NO/c1-2-3-4-9-5-7-10(8-6-9)19-11(20)12(14,15)13(16,17)18/h5-8H,2-4H2,1H3,(H,19,20) |
| InChIKey | ZFNMZPTXWDXUDX-UHFFFAOYSA-N |
| Molecular Weight | 295.253 g/mol |
| SMILES | C(CCC)C1=CC=C(C=C1)NC(C(C(F)(F)F)(F)F)=O |