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N-(3,4-dimethoxybenzyl)-N-[3-(4-morpholinyl)propyl]-N'-phenylurea
SpectraBase Compound ID Fo70e44c2VF
InChI InChI=1S/C23H31N3O4/c1-28-21-10-9-19(17-22(21)29-2)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 JGTSZZZMOHLHKB-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 E2XeHswWdFL
Name N-(3,4-Dimethoxybenzyl)-N-[3-(4-morpholinyl)propyl]-N'-phenylurea
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 413.231456486 u
Formula C23H31N3O4
InChI InChI=1S/C23H31N3O4/c1-28-21-10-9-19(17-22(21)29-2)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 JGTSZZZMOHLHKB-UHFFFAOYSA-N
Molecular Weight 413.518 g/mol
SMILES N(C(N(CC=1C=C(OC)C(=CC1)OC)CCCN1CCOCC1)=O)C1=CC=CC=C1