![1-[5-(Dimethylamino)-2-fluoro-4-nitrophenyl]-3-pipecoline](/api/spectrum/F2qfsOW6sB7/structure.png?h=300&w=458 "1-[5-(Dimethylamino)-2-fluoro-4-nitrophenyl]-3-pipecoline")
| SpectraBase Compound ID | Hot3jxwy9QX |
|---|---|
| InChI | InChI=1S/C14H20FN3O2/c1-10-5-4-6-17(9-10)12-8-13(16(2)3)14(18(19)20)7-11(12)15/h7-8,10H,4-6,9H2,1-3H3 |
| InChIKey | YGOFPKSTSOPTPT-UHFFFAOYSA-N |
| Mol Weight | 281.33 g/mol |
| Molecular Formula | C14H20FN3O2 |
| Exact Mass | 281.153955 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | F2qfsOW6sB7 |
|---|---|
| Name | 1-[5-(Dimethylamino)-2-fluoro-4-nitrophenyl]-3-pipecoline |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 281.153955057 u |
| Formula | C14H20FN3O2 |
| InChI | InChI=1S/C14H20FN3O2/c1-10-5-4-6-17(9-10)12-8-13(16(2)3)14(18(19)20)7-11(12)15/h7-8,10H,4-6,9H2,1-3H3 |
| InChIKey | YGOFPKSTSOPTPT-UHFFFAOYSA-N |
| Molecular Weight | 281.331 g/mol |
| SMILES | N(=O)(=O)C1=C(C=C(C(=C1)F)N1CC(CCC1)C)N(C)C |