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2,4-Dichlorophenethylamine N-4-toluoyl-N-4-methylbenzyl

View entire compound with spectra: 1 NMR, and 1 MS (GC)

2,4-Dichlorophenethylamine N-4-toluoyl-N-4-methylbenzyl
SpectraBase Compound ID 5EGZYw3EqKd
InChI InChI=1S/C24H23Cl2NO/c1-17-3-7-19(8-4-17)16-27(24(28)21-9-5-18(2)6-10-21)14-13-20-11-12-22(25)15-23(20)26/h3-12,15H,13-14,16H2,1-2H3
InChIKey MYKNYLUFNXQBMS-UHFFFAOYSA-N
Mol Weight 412.36 g/mol
Molecular Formula C24H23Cl2NO
Exact Mass 411.11567 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BfdGOrWnGuO
Name 2,4-Dichlorophenethylamine N-4-toluoyl-N-4-methylbenzyl
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 411.115669764 u
Formula C24H23Cl2NO
InChI InChI=1S/C24H23Cl2NO/c1-17-3-7-19(8-4-17)16-27(24(28)21-9-5-18(2)6-10-21)14-13-20-11-12-22(25)15-23(20)26/h3-12,15H,13-14,16H2,1-2H3
InChIKey MYKNYLUFNXQBMS-UHFFFAOYSA-N
Molecular Weight 412.360 g/mol
SMILES C(N(CC=1C=CC(=CC1)C)CCC1=C(C=C(C=C1)Cl)Cl)(C1=CC=C(C=C1)C)=O