![3-Methylpentanal oxime, o-[(pentafluorophenyl)methyl]-](/api/spectrum/HflELIGQlgW/structure.png?h=300&w=458 "3-Methylpentanal oxime, o-[(pentafluorophenyl)methyl]-")
| SpectraBase Compound ID | ALsWITSI693 |
|---|---|
| InChI | InChI=1S/C13H14F5NO/c1-3-7(2)4-5-19-20-6-8-9(14)11(16)13(18)12(17)10(8)15/h5,7H,3-4,6H2,1-2H3/b19-5+ |
| InChIKey | YPZISISXUIVYEB-PTXOJBNSSA-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 | HflELIGQlgW |
|---|---|
| Name | 3-Methylpentanal oxime, o-[(pentafluorophenyl)methyl]- |
| 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/c1-3-7(2)4-5-19-20-6-8-9(14)11(16)13(18)12(17)10(8)15/h5,7H,3-4,6H2,1-2H3/b19-5+ |
| InChIKey | YPZISISXUIVYEB-PTXOJBNSSA-N |
| Molecular Weight | 295.253 g/mol |
| SMILES | CCC(C)C\C=N\OCC1=C(F)C(F)=C(C(=C1F)F)F |