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1,1'-(4-Methyl-m-phenylene)bis[3,3-diallylurea

View entire compound with spectra: 3 NMR, 1 FTIR, and 1 Raman

1,1'-(4-Methyl-m-phenylene)bis[3,3-diallylurea
SpectraBase Compound ID 4JG7qGAT3OQ
InChI InChI=1S/C21H28N4O2/c1-6-12-24(13-7-2)20(26)22-18-11-10-17(5)19(16-18)23-21(27)25(14-8-3)15-9-4/h6-11,16H,1-4,12-15H2,5H3,(H,22,26)(H,23,27)
InChIKey CLLVAYOJIXSSDC-UHFFFAOYSA-N
Mol Weight 368.48 g/mol
Molecular Formula C21H28N4O2
Exact Mass 368.221226 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID A1tLpgTZFyf
Name 1,1'-(4-Methyl-m-phenylene)bis[3,3-diallylurea
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 368.221226156 u
Formula C21H28N4O2
InChI InChI=1S/C21H28N4O2/c1-6-12-24(13-7-2)20(26)22-18-11-10-17(5)19(16-18)23-21(27)25(14-8-3)15-9-4/h6-11,16H,1-4,12-15H2,5H3,(H,22,26)(H,23,27)
InChIKey CLLVAYOJIXSSDC-UHFFFAOYSA-N
Molecular Weight 368.481 g/mol
SMILES N(C=1C=CC(=C(C1)NC(N(CC=C)CC=C)=O)C)C(N(CC=C)CC=C)=O