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N-(4-chloro-2-phenoxyphenyl)-N'-(2,5-dimethoxyphenyl)urea
SpectraBase Compound ID IGiLUCZovYY
InChI InChI=1S/C21H19ClN2O4/c1-26-16-9-11-19(27-2)18(13-16)24-21(25)23-17-10-8-14(22)12-20(17)28-15-6-4-3-5-7-15/h3-13H,1-2H3,(H2,23,24,25)
InChIKey SCYCJPYOIFPEKB-UHFFFAOYSA-N
Mol Weight 398.85 g/mol
Molecular Formula C21H19ClN2O4
Exact Mass 398.103335 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LyZyXW05oN4
Name N-(4-Chloro-2-phenoxyphenyl)-N'-(2,5-dimethoxyphenyl)urea
Comments Computed using HOSE algorithm
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Exact Mass 398.103334796 u
Formula C21H19ClN2O4
InChI InChI=1S/C21H19ClN2O4/c1-26-16-9-11-19(27-2)18(13-16)24-21(25)23-17-10-8-14(22)12-20(17)28-15-6-4-3-5-7-15/h3-13H,1-2H3,(H2,23,24,25)
InChIKey SCYCJPYOIFPEKB-UHFFFAOYSA-N
Molecular Weight 398.846 g/mol
SMILES N(C=1C=C(C=CC1OC)OC)C(NC=1C(=CC(=CC1)Cl)OC=1C=CC=CC1)=O