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N-(2,4-dichlorobenzyl)-N'-[2-(trifluoromethyl)phenyl]urea

View entire compound with spectra: 2 NMR

N-(2,4-dichlorobenzyl)-N'-[2-(trifluoromethyl)phenyl]urea
SpectraBase Compound ID Br9CyM8u04u
InChI InChI=1S/C15H11Cl2F3N2O/c16-10-6-5-9(12(17)7-10)8-21-14(23)22-13-4-2-1-3-11(13)15(18,19)20/h1-7H,8H2,(H2,21,22,23)
InChIKey PRKQPVHSTJOZSP-UHFFFAOYSA-N
Mol Weight 363.17 g/mol
Molecular Formula C15H11Cl2F3N2O
Exact Mass 362.020053 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8JjmOrc0ocg
Name N-(2,4-Dichlorobenzyl)-N'-[2-(trifluoromethyl)phenyl]urea
Comments Computed using HOSE algorithm
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Exact Mass 362.020052870 u
Formula C15H11Cl2F3N2O
InChI InChI=1S/C15H11Cl2F3N2O/c16-10-6-5-9(12(17)7-10)8-21-14(23)22-13-4-2-1-3-11(13)15(18,19)20/h1-7H,8H2,(H2,21,22,23)
InChIKey PRKQPVHSTJOZSP-UHFFFAOYSA-N
Molecular Weight 363.167 g/mol
SMILES N(C(NCC=1C(=CC(=CC1)Cl)Cl)=O)C1=C(C(F)(F)F)C=CC=C1