![Methyl({[3-(pyrimidin-2-yloxy)phenyl]methyl})amine](/api/spectrum/5gmlsrmikYq/structure.png?h=300&w=458 "Methyl({[3-(pyrimidin-2-yloxy)phenyl]methyl})amine")
| SpectraBase Compound ID | 8xgH88cl97r |
|---|---|
| InChI | InChI=1S/C12H13N3O/c1-13-9-10-4-2-5-11(8-10)16-12-14-6-3-7-15-12/h2-8,13H,9H2,1H3 |
| InChIKey | XDEUAGLSWXWHIF-UHFFFAOYSA-N |
| Mol Weight | 215.26 g/mol |
| Molecular Formula | C12H13N3O |
| Exact Mass | 215.105862 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5gmlsrmikYq |
|---|---|
| Name | Methyl({[3-(pyrimidin-2-yloxy)phenyl]methyl})amine |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 215.105862050 u |
| Formula | C12H13N3O |
| InChI | InChI=1S/C12H13N3O/c1-13-9-10-4-2-5-11(8-10)16-12-14-6-3-7-15-12/h2-8,13H,9H2,1H3 |
| InChIKey | XDEUAGLSWXWHIF-UHFFFAOYSA-N |
| Molecular Weight | 215.256 g/mol |
| SMILES | C1(=NC=CC=N1)OC1=CC(=CC=C1)CNC |