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1,1'-(4-Methyl-m-phenylene)bis[3-benzyl-3-methylurea]
SpectraBase Compound ID B8XYZEcK6KS
InChI InChI=1S/C25H28N4O2/c1-19-14-15-22(26-24(30)28(2)17-20-10-6-4-7-11-20)16-23(19)27-25(31)29(3)18-21-12-8-5-9-13-21/h4-16H,17-18H2,1-3H3,(H,26,30)(H,27,31)
InChIKey NQZYLGNFFXADBD-UHFFFAOYSA-N
Mol Weight 416.53 g/mol
Molecular Formula C25H28N4O2
Exact Mass 416.221226 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9SzWPyWjELD
Name 1,1'-(4-Methyl-m-phenylene)bis[3-benzyl-3-methylurea]
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 416.221226156 u
Formula C25H28N4O2
InChI InChI=1S/C25H28N4O2/c1-19-14-15-22(26-24(30)28(2)17-20-10-6-4-7-11-20)16-23(19)27-25(31)29(3)18-21-12-8-5-9-13-21/h4-16H,17-18H2,1-3H3,(H,26,30)(H,27,31)
InChIKey NQZYLGNFFXADBD-UHFFFAOYSA-N
Molecular Weight 416.525 g/mol
SMILES N(C=1C=CC(=C(C1)NC(N(CC=1C=CC=CC1)C)=O)C)C(N(CC=1C=CC=CC1)C)=O