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4-Benzylidene-1-butyl-2-[morpholino(p-tolyl)methyl]-1H-imidazol-5(4H)-one
SpectraBase Compound ID 5DxLzBpULrC
InChI InChI=1S/C26H31N3O2/c1-3-4-14-29-25(27-23(26(29)30)19-21-8-6-5-7-9-21)24(28-15-17-31-18-16-28)22-12-10-20(2)11-13-22/h5-13,19,24H,3-4,14-18H2,1-2H3/b23-19-
InChIKey DZEBZNYTZMJXAV-NMWGTECJSA-N
Mol Weight 417.55 g/mol
Molecular Formula C26H31N3O2
Exact Mass 417.241627 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KHMCsLUEoqn
Name 4-Benzylidene-1-butyl-2-[morpholino(p-tolyl)methyl]-1H-imidazol-5(4H)-one
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 417.241627248 u
Formula C26H31N3O2
InChI InChI=1S/C26H31N3O2/c1-3-4-14-29-25(27-23(26(29)30)19-21-8-6-5-7-9-21)24(28-15-17-31-18-16-28)22-12-10-20(2)11-13-22/h5-13,19,24H,3-4,14-18H2,1-2H3/b23-19-
InChIKey DZEBZNYTZMJXAV-NMWGTECJSA-N
Molecular Weight 417.553 g/mol
SMILES C=1(N(C(=O)\C(N1)=C\C1=CC=CC=C1)CCCC)C(N1CCOCC1)C1=CC=C(C=C1)C