| SpectraBase Compound ID | 1UrF7QPHNAV |
|---|---|
| InChI | InChI=1S/C11H11N3/c1-8-3-2-4-9(7-8)10-5-6-13-11(12)14-10/h2-7H,1H3,(H2,12,13,14) |
| InChIKey | RBSPVLOREUTISS-UHFFFAOYSA-N |
| Mol Weight | 185.23 g/mol |
| Molecular Formula | C11H11N3 |
| Exact Mass | 185.095297 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JLyUGI0OcbA |
|---|---|
| Name | 4-(3-Methylphenyl)-2-pyrimidinamine |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 185.095297366 u |
| Formula | C11H11N3 |
| InChI | InChI=1S/C11H11N3/c1-8-3-2-4-9(7-8)10-5-6-13-11(12)14-10/h2-7H,1H3,(H2,12,13,14) |
| InChIKey | RBSPVLOREUTISS-UHFFFAOYSA-N |
| SMILES | NC=1N=C(C=2C=C(C)C=CC2)C=CN1 |