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Urea, N-[4-(4-fluorophenyl)-6-(trifluoromethyl)-2-pyrimidinyl]-N'-(3-methylbenzoyl)-
SpectraBase Compound ID CTGdpy8zxuN
InChI InChI=1S/C20H14F4N4O2/c1-11-3-2-4-13(9-11)17(29)27-19(30)28-18-25-15(10-16(26-18)20(22,23)24)12-5-7-14(21)8-6-12/h2-10H,1H3,(H2,25,26,27,28,29,30)
InChIKey OAUAXLQMHXTJMF-UHFFFAOYSA-N
Mol Weight 418.35 g/mol
Molecular Formula C20H14F4N4O2
Exact Mass 418.105288 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BNxGeAJxVnW
Name Urea, N-[4-(4-fluorophenyl)-6-(trifluoromethyl)-2-pyrimidinyl]-N'-(3-methylbenzoyl)-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H14F4N4O2
InChI InChI=1S/C20H14F4N4O2/c1-11-3-2-4-13(9-11)17(29)27-19(30)28-18-25-15(10-16(26-18)20(22,23)24)12-5-7-14(21)8-6-12/h2-10H,1H3,(H2,25,26,27,28,29,30)
InChIKey OAUAXLQMHXTJMF-UHFFFAOYSA-N
Molecular Weight 418.352 g/mol
SMILES N(C(Nc1nc(-c2ccc(cc2)F)cc(n1)C(F)(F)F)=O)C(=O)c1cc(ccc1)C
SPLASH splash10-066r-8951100000-d1f993a01576e4e79dcb
Source of Spectrum IY-1-4472-2
Synonyms N-[[[4-(4-fluorophenyl)-6-(trifluoromethyl)-2-pyrimidinyl]amino]-oxomethyl]-3-methylbenzamide N-[[4-(4-fluorophenyl)-6-(trifluoromethyl)pyrimidin-2-yl]carbamoyl]-3-methylbenzamide
Wiley ID 1652705