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1-{4-[2,5-bis(2,2,2-trifluoroethoxy)phenyl]-2-pyrimidinyl}-3-(m-chlorophenyl)urea

View entire compound with spectra: 2 NMR, and 1 FTIR

1-{4-[2,5-bis(2,2,2-trifluoroethoxy)phenyl]-2-pyrimidinyl}-3-(m-chlorophenyl)urea
SpectraBase Compound ID 7wFjzAXQiBg
InChI InChI=1S/C21H15ClF6N4O3/c22-12-2-1-3-13(8-12)30-19(33)32-18-29-7-6-16(31-18)15-9-14(34-10-20(23,24)25)4-5-17(15)35-11-21(26,27)28/h1-9H,10-11H2,(H2,29,30,31,32,33)
InChIKey VUBDLMKREHXWKE-UHFFFAOYSA-N
Mol Weight 520.82 g/mol
Molecular Formula C21H15ClF6N4O3
Exact Mass 520.073687 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID EzmSgDJoWpO
Name 1-{4-[2,5-BIS(2,2,2-TRIFLUOROETHOXY)PHENYL]-2-PYRIMIDINYL}-3-(m-CHLOROPHENYL)UREA
Source of Sample Maybridge Chemical Company Ltd., North Cornwall, England
Copyright Copyright © 1991-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H15ClF6N4O3
InChI InChI=1S/C21H15ClF6N4O3/c22-12-2-1-3-13(8-12)30-19(33)32-18-29-7-6-16(31-18)15-9-14(34-10-20(23,24)25)4-5-17(15)35-11-21(26,27)28/h1-9H,10-11H2,(H2,29,30,31,32,33)
InChIKey VUBDLMKREHXWKE-UHFFFAOYSA-N
Instrument Name BRUKER AC-300
Melting Point 200-202C
Molecular Weight 520.82
Solvent Polysol; Reference=TMS; Temperature 297K