| SpectraBase Compound ID | 8PZLhMa0ksd |
|---|---|
| InChI | InChI=1S/C11H8Cl3N3/c12-11(13,14)9-6-7-15-10(17-9)16-8-4-2-1-3-5-8/h1-7H,(H,15,16,17) |
| InChIKey | LHAYZNCBCURKFH-UHFFFAOYSA-N |
| Mol Weight | 288.56 g/mol |
| Molecular Formula | C11H8Cl3N3 |
| Exact Mass | 286.97838 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | ADl80muHtX8 |
|---|---|
| Name | 4-(Trichloromethyl)-2-(N-phenylamino)-1,3-pyrimidine |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 286.978380370 u |
| Formula | C11H8Cl3N3 |
| InChI | InChI=1S/C11H8Cl3N3/c12-11(13,14)9-6-7-15-10(17-9)16-8-4-2-1-3-5-8/h1-7H,(H,15,16,17) |
| InChIKey | LHAYZNCBCURKFH-UHFFFAOYSA-N |
| Molecular Weight | 288.565 g/mol |
| SMILES | C(C1=NC(NC2=CC=CC=C2)=NC=C1)(Cl)(Cl)Cl |