| SpectraBase Compound ID | I5yVQfLtDfN |
|---|---|
| InChI | InChI=1S/C12H12N2/c13-12-4-2-1-3-11(12)9-10-5-7-14-8-6-10/h1-8H,9,13H2 |
| InChIKey | DCAKFEKEDOKREQ-UHFFFAOYSA-N |
| Mol Weight | 184.24 g/mol |
| Molecular Formula | C12H12N2 |
| Exact Mass | 184.100048 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | I1ayXXdL4m1 |
|---|---|
| Name | 2-(4-Pyridylmethyl)aniline |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 184.100048394 u |
| Formula | C12H12N2 |
| InChI | InChI=1S/C12H12N2/c13-12-4-2-1-3-11(12)9-10-5-7-14-8-6-10/h1-8H,9,13H2 |
| InChIKey | DCAKFEKEDOKREQ-UHFFFAOYSA-N |
| Molecular Weight | 184.242 g/mol |
| SMILES | C=1(CC2=CC=NC=C2)C(N)=CC=CC1 |