| SpectraBase Compound ID | BpBssLwzfs2 |
|---|---|
| InChI | InChI=1S/C17H19F2N/c1-3-20(4-2)17(13-5-9-15(18)10-6-13)14-7-11-16(19)12-8-14/h5-12,17H,3-4H2,1-2H3 |
| InChIKey | IACNAVILDFMFAI-UHFFFAOYSA-N |
| Mol Weight | 275.34 g/mol |
| Molecular Formula | C17H19F2N |
| Exact Mass | 275.148556 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7Lxt57SM6io |
|---|---|
| Name | Almitrine-artifact 2 |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 275.148555942 u |
| Formula | C17H19F2N |
| InChI | InChI=1S/C17H19F2N/c1-3-20(4-2)17(13-5-9-15(18)10-6-13)14-7-11-16(19)12-8-14/h5-12,17H,3-4H2,1-2H3 |
| InChIKey | IACNAVILDFMFAI-UHFFFAOYSA-N |
| Molecular Weight | 275.343 g/mol |
| SMILES | c1(ccc(cc1)C(N(CC)CC)c1ccc(cc1)F)F |