| SpectraBase Compound ID | IIajkE2CVyh |
|---|---|
| InChI | InChI=1S/C16H18FN/c1-13-4-2-3-5-15(13)12-18-11-10-14-6-8-16(17)9-7-14/h2-9,18H,10-12H2,1H3 |
| InChIKey | VAQBVCZRTZYAKM-UHFFFAOYSA-N |
| Mol Weight | 243.33 g/mol |
| Molecular Formula | C16H18FN |
| Exact Mass | 243.142328 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LAx9V2LVdRe |
|---|---|
| Name | 4-Fluorophenethylamine 2-methylbenzyl |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 243.142327747 u |
| Formula | C16H18FN |
| InChI | InChI=1S/C16H18FN/c1-13-4-2-3-5-15(13)12-18-11-10-14-6-8-16(17)9-7-14/h2-9,18H,10-12H2,1H3 |
| InChIKey | VAQBVCZRTZYAKM-UHFFFAOYSA-N |
| Molecular Weight | 243.325 g/mol |
| SMILES | C1(=C(C=CC=C1)C)CNCCC1=CC=C(C=C1)F |