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urea, N-[(2,5-dimethoxyphenyl)methyl]-N-[3-(4-morpholinyl)propyl]-N'-phenyl-
SpectraBase Compound ID IU12TupF84o
InChI InChI=1S/C23H31N3O4/c1-28-21-9-10-22(29-2)19(17-21)18-26(12-6-11-25-13-15-30-16-14-25)23(27)24-20-7-4-3-5-8-20/h3-5,7-10,17H,6,11-16,18H2,1-2H3,(H,24,27)
InChIKey XWBUHWSHLTWLJX-UHFFFAOYSA-N
Mol Weight 413.52 g/mol
Molecular Formula C23H31N3O4
Exact Mass 413.231456 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GQBzILWyhdp
Name Urea, N-[(2,5-dimethoxyphenyl)methyl]-N-[3-(4-morpholinyl)propyl]-N'-phenyl-
Comments Computed using HOSE algorithm
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Exact Mass 413.231456486 u
Formula C23H31N3O4
InChI InChI=1S/C23H31N3O4/c1-28-21-9-10-22(29-2)19(17-21)18-26(12-6-11-25-13-15-30-16-14-25)23(27)24-20-7-4-3-5-8-20/h3-5,7-10,17H,6,11-16,18H2,1-2H3,(H,24,27)
InChIKey XWBUHWSHLTWLJX-UHFFFAOYSA-N
Molecular Weight 413.518 g/mol
SMILES N(C(N(CC=1C(=CC=C(C1)OC)OC)CCCN1CCOCC1)=O)C=1C=CC=CC1