![6-Methyl-5-hepten-2-one oxime, o-[(pentafluorophenyl)methyl]-](/api/spectrum/9QWtiJlgdbb/structure.png?h=300&w=458 "6-Methyl-5-hepten-2-one oxime, o-[(pentafluorophenyl)methyl]-")
| SpectraBase Compound ID | 26bgaaoiWtp |
|---|---|
| InChI | InChI=1S/C15H16F5NO/c1-8(2)5-4-6-9(3)21-22-7-10-11(16)13(18)15(20)14(19)12(10)17/h5H,4,6-7H2,1-3H3/b21-9+ |
| InChIKey | UNYXAVQWMIOYNJ-ZVBGSRNCSA-N |
| Mol Weight | 321.29 g/mol |
| Molecular Formula | C15H16F5NO |
| Exact Mass | 321.115205 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9QWtiJlgdbb |
|---|---|
| Name | 6-Methyl-5-hepten-2-one oxime, o-[(pentafluorophenyl)methyl]- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 321.115204953 u |
| Formula | C15H16F5NO |
| InChI | InChI=1S/C15H16F5NO/c1-8(2)5-4-6-9(3)21-22-7-10-11(16)13(18)15(20)14(19)12(10)17/h5H,4,6-7H2,1-3H3/b21-9+ |
| InChIKey | UNYXAVQWMIOYNJ-ZVBGSRNCSA-N |
| Molecular Weight | 321.291 g/mol |
| SMILES | CC(C)=CCC\C(C)=N\OCC1=C(F)C(F)=C(C(=C1F)F)F |