![4-Fluoro-N-[2-(thiophen-2-yl)ethyl]aniline](/api/spectrum/BZLBrPegvP8/structure.png?h=300&w=458 "4-Fluoro-N-[2-(thiophen-2-yl)ethyl]aniline")
| SpectraBase Compound ID | IqPj1ucbYQz |
|---|---|
| InChI | InChI=1S/C12H12FNS/c13-10-3-5-11(6-4-10)14-8-7-12-2-1-9-15-12/h1-6,9,14H,7-8H2 |
| InChIKey | QMGCJWFCJAGGPQ-UHFFFAOYSA-N |
| Mol Weight | 221.29 g/mol |
| Molecular Formula | C12H12FNS |
| Exact Mass | 221.067449 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BZLBrPegvP8 |
|---|---|
| Name | 4-Fluoro-N-[2-(thiophen-2-yl)ethyl]aniline |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 221.067448727 u |
| Formula | C12H12FNS |
| InChI | InChI=1S/C12H12FNS/c13-10-3-5-11(6-4-10)14-8-7-12-2-1-9-15-12/h1-6,9,14H,7-8H2 |
| InChIKey | QMGCJWFCJAGGPQ-UHFFFAOYSA-N |
| Molecular Weight | 221.293 g/mol |
| SMILES | C1(NCCC=2SC=CC2)=CC=C(C=C1)F |