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N-(3-methylphenyl)-N'-[1-(4-methylphenyl)ethyl]urea
SpectraBase Compound ID EUfKarJWS4J
InChI InChI=1S/C17H20N2O/c1-12-7-9-15(10-8-12)14(3)18-17(20)19-16-6-4-5-13(2)11-16/h4-11,14H,1-3H3,(H2,18,19,20)
InChIKey KVYBEVCETYRLMY-UHFFFAOYSA-N
Mol Weight 268.36 g/mol
Molecular Formula C17H20N2O
Exact Mass 268.157563 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID D8E1Lyhr4K7
Name N-(3-Methylphenyl)-N'-[1-(4-methylphenyl)ethyl]urea
Comments Computed using HOSE algorithm
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Exact Mass 268.157563271 u
Formula C17H20N2O
InChI InChI=1S/C17H20N2O/c1-12-7-9-15(10-8-12)14(3)18-17(20)19-16-6-4-5-13(2)11-16/h4-11,14H,1-3H3,(H2,18,19,20)
InChIKey KVYBEVCETYRLMY-UHFFFAOYSA-N
Molecular Weight 268.360 g/mol
SMILES N(C(C=1C=CC(=CC1)C)C)C(NC=1C=C(C)C=CC1)=O