![1-{4-[2,5-bis(2,2,2-trifluoroethoxy)phenyl]-2-pyrimidinyl}-3-methylurea](/api/spectrum/31ynBRvM5pZ/structure.png?h=300&w=458 "1-{4-[2,5-bis(2,2,2-trifluoroethoxy)phenyl]-2-pyrimidinyl}-3-methylurea")
| SpectraBase Compound ID | 7lMMWl9Kv73 |
|---|---|
| InChI | InChI=1S/C16H14F6N4O3/c1-23-14(27)26-13-24-5-4-11(25-13)10-6-9(28-7-15(17,18)19)2-3-12(10)29-8-16(20,21)22/h2-6H,7-8H2,1H3,(H2,23,24,25,26,27) |
| InChIKey | WHUZNYJAQMPWEX-UHFFFAOYSA-N |
| Mol Weight | 424.3 g/mol |
| Molecular Formula | C16H14F6N4O3 |
| Exact Mass | 424.097009 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 31ynBRvM5pZ |
|---|---|
| Name | 1-{4-[2,5-bis(2,2,2-trifluoroethoxy)phenyl]-2-pyrimidinyl}-3-methylurea |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C16H14F6N4O3 |
| InChI | InChI=1S/C16H14F6N4O3/c1-23-14(27)26-13-24-5-4-11(25-13)10-6-9(28-7-15(17,18)19)2-3-12(10)29-8-16(20,21)22/h2-6H,7-8H2,1H3,(H2,23,24,25,26,27) |
| InChIKey | WHUZNYJAQMPWEX-UHFFFAOYSA-N |
| Instrument Name | Varian CFT-20 |
| Sadtler NMR Number | 56684M |
| Solvent | Polysol |