| SpectraBase Compound ID | D4ofuFXR7yH |
|---|---|
| InChI | InChI=1S/C5H3F3N2O/c6-5(7,8)3-1-4(11)10-2-9-3/h1-2H,(H,9,10,11) |
| InChIKey | LVOYSBZJJWPUBD-UHFFFAOYSA-N |
| Mol Weight | 164.09 g/mol |
| Molecular Formula | C5H3F3N2O |
| Exact Mass | 164.019747 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 3FGhMDV02wv |
|---|---|
| Name | 6-(Trifluoromethyl)pyrimidin-4(3H)-one |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C5H3F3N2O |
| InChI | InChI=1S/C5H3F3N2O/c6-5(7,8)3-1-4(11)10-2-9-3/h1-2H,(H,9,10,11) |
| InChIKey | LVOYSBZJJWPUBD-UHFFFAOYSA-N |
| Molecular Weight | 164.087 g/mol |
| SMILES | N1C(C=C(N=C1)C(F)(F)F)=O |
| SPLASH | splash10-03dr-0900000000-59ec25266e57ee15235c |
| Source of Spectrum | K1-2004-3716-6 |
| Synonyms | 6-(trifluoromethyl)-1H-pyrimidin-4-one |
| Wiley ID | 1561464 |