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4-[(3,4-dimethylphenoxy)methyl]-N-[1-(4-isopropylphenyl)propyl]benzamide
SpectraBase Compound ID 1QoCE9KGMwm
InChI InChI=1S/C28H33NO2/c1-6-27(24-14-12-23(13-15-24)19(2)3)29-28(30)25-10-8-22(9-11-25)18-31-26-16-7-20(4)21(5)17-26/h7-17,19,27H,6,18H2,1-5H3,(H,29,30)
InChIKey JRAVFNISFYXOCH-UHFFFAOYSA-N
Mol Weight 415.6 g/mol
Molecular Formula C28H33NO2
Exact Mass 415.251129 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IQsYOyhtlOQ
Name 4-[(3,4-Dimethylphenoxy)methyl]-N-[1-(4-isopropylphenyl)propyl]benzamide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 415.251129305 u
Formula C28H33NO2
InChI InChI=1S/C28H33NO2/c1-6-27(24-14-12-23(13-15-24)19(2)3)29-28(30)25-10-8-22(9-11-25)18-31-26-16-7-20(4)21(5)17-26/h7-17,19,27H,6,18H2,1-5H3,(H,29,30)
InChIKey JRAVFNISFYXOCH-UHFFFAOYSA-N
Molecular Weight 415.577 g/mol
SMILES N(C(C=1C=CC(=CC1)COC1=CC(C)=C(C=C1)C)=O)C(C1=CC=C(C=C1)C(C)C)CC