| SpectraBase Compound ID | DEinpeIUACF |
|---|---|
| InChI | InChI=1S/C18H19ClN2/c1-13(21-12-16-4-2-3-5-17(16)19)10-14-6-7-15-8-9-20-18(15)11-14/h2-9,11,13,20-21H,10,12H2,1H3 |
| InChIKey | UUEJFWZWCZQNEM-UHFFFAOYSA-N |
| Mol Weight | 298.82 g/mol |
| Molecular Formula | C18H19ClN2 |
| Exact Mass | 298.123676 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | eKEF3hRk6q |
|---|---|
| Name | 6-Apin N-(2-chlorobenzyl) |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 298.123676320 u |
| Formula | C18H19ClN2 |
| InChI | InChI=1S/C18H19ClN2/c1-13(21-12-16-4-2-3-5-17(16)19)10-14-6-7-15-8-9-20-18(15)11-14/h2-9,11,13,20-21H,10,12H2,1H3 |
| InChIKey | UUEJFWZWCZQNEM-UHFFFAOYSA-N |
| SMILES | C12=C(C=CC(=C2)CC(NCC=2C(=CC=CC2)Cl)C)C=CN1 |