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Ethyl 2-[benzyl(4-methoxyphenyl)amino]-4-phenylbutyrate
SpectraBase Compound ID 2hpucFj56j2
InChI InChI=1S/C26H29NO3/c1-3-30-26(28)25(19-14-21-10-6-4-7-11-21)27(20-22-12-8-5-9-13-22)23-15-17-24(29-2)18-16-23/h4-13,15-18,25H,3,14,19-20H2,1-2H3
InChIKey ZYLOYZRPGSKCAL-UHFFFAOYSA-N
Mol Weight 403.52 g/mol
Molecular Formula C26H29NO3
Exact Mass 403.214744 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID UlBsr1uZRo
Name Ethyl 2-[benzyl(4-methoxyphenyl)amino]-4-phenylbutyrate
Comments Computed using HOSE algorithm
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Exact Mass 403.214743795 u
Formula C26H29NO3
InChI InChI=1S/C26H29NO3/c1-3-30-26(28)25(19-14-21-10-6-4-7-11-21)27(20-22-12-8-5-9-13-22)23-15-17-24(29-2)18-16-23/h4-13,15-18,25H,3,14,19-20H2,1-2H3
InChIKey ZYLOYZRPGSKCAL-UHFFFAOYSA-N
Molecular Weight 403.522 g/mol
SMILES C(C(CCC=1C=CC=CC1)N(C=1C=CC(=CC1)OC)CC=1C=CC=CC1)(=O)OCC