| SpectraBase Compound ID | DLrDIlYQOML |
|---|---|
| InChI | InChI=1S/C10H8ClN3O/c11-8-6-9(14-10(12)13-8)15-7-4-2-1-3-5-7/h1-6H,(H2,12,13,14) |
| InChIKey | WCDHWNAYCBWKKW-UHFFFAOYSA-N |
| Mol Weight | 221.65 g/mol |
| Molecular Formula | C10H8ClN3O |
| Exact Mass | 221.03559 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Gr9eGDpz2cF |
|---|---|
| Name | 2-Pyrimidinamine, 4-chloro-6-phenoxy- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 221.035589589 u |
| Formula | C10H8ClN3O |
| InChI | InChI=1S/C10H8ClN3O/c11-8-6-9(14-10(12)13-8)15-7-4-2-1-3-5-7/h1-6H,(H2,12,13,14) |
| InChIKey | WCDHWNAYCBWKKW-UHFFFAOYSA-N |
| SMILES | NC=1N=C(C=C(N1)OC1=CC=CC=C1)Cl |