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Urea, N-[4-[2-chloro-4-(trifluoromethyl)phenoxy]phenyl]-N'-methyl-
SpectraBase Compound ID FAzy1F6IBy
InChI InChI=1S/C15H12ClF3N2O2/c1-20-14(22)21-10-3-5-11(6-4-10)23-13-7-2-9(8-12(13)16)15(17,18)19/h2-8H,1H3,(H2,20,21,22)
InChIKey BUJYGHDNZJHQSU-UHFFFAOYSA-N
Mol Weight 344.72 g/mol
Molecular Formula C15H12ClF3N2O2
Exact Mass 344.05394 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JiN2KTcIRiB
Name Urea, N-[4-[2-chloro-4-(trifluoromethyl)phenoxy]phenyl]-N'-methyl-
Comments Computed using HOSE algorithm
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Exact Mass 344.053939821 u
Formula C15H12ClF3N2O2
InChI InChI=1S/C15H12ClF3N2O2/c1-20-14(22)21-10-3-5-11(6-4-10)23-13-7-2-9(8-12(13)16)15(17,18)19/h2-8H,1H3,(H2,20,21,22)
InChIKey BUJYGHDNZJHQSU-UHFFFAOYSA-N
Molecular Weight 344.721 g/mol
SMILES N(C1=CC=C(OC2=C(C=C(C=C2)C(F)(F)F)Cl)C=C1)C(NC)=O