| SpectraBase Compound ID | 3Ev8v4CMArr |
|---|---|
| InChI | InChI=1S/C12H12F5NO/c1-2-3-4-5-18-19-6-7-8(13)10(15)12(17)11(16)9(7)14/h5H,2-4,6H2,1H3/b18-5+ |
| InChIKey | CQVUQQBKUBLHIZ-BLLMUTORSA-N |
| Mol Weight | 281.23 g/mol |
| Molecular Formula | C12H12F5NO |
| Exact Mass | 281.083905 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JoQRQfT8Bke |
|---|---|
| Name | Pentanal o-pentafluorophenylmethyl-oxime |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 281.083904824 u |
| Formula | C12H12F5NO |
| InChI | InChI=1S/C12H12F5NO/c1-2-3-4-5-18-19-6-7-8(13)10(15)12(17)11(16)9(7)14/h5H,2-4,6H2,1H3/b18-5+ |
| InChIKey | CQVUQQBKUBLHIZ-BLLMUTORSA-N |
| Molecular Weight | 281.226 g/mol |
| SMILES | C1(=C(C(=C(C(=C1F)F)F)F)F)CO\N=C\CCCC |