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2-(1-[4-Methyl-benzoyl]-2-phenyl-ethylidene)-hexahydro-1,3-diazepine

View entire compound with spectra: 1 NMR

2-(1-[4-Methyl-benzoyl]-2-phenyl-ethylidene)-hexahydro-1,3-diazepine
SpectraBase Compound ID KXyznojQGKo
InChI InChI=1S/C21H24N2O/c1-16-9-11-18(12-10-16)20(24)19(15-17-7-3-2-4-8-17)21-22-13-5-6-14-23-21/h2-4,7-12,22-23H,5-6,13-15H2,1H3
InChIKey AWLQWIRYNGHYAG-UHFFFAOYSA-N
Mol Weight 320.44 g/mol
Molecular Formula C21H24N2O
Exact Mass 320.188863 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1YSeC4MZ6kf
Name 2-(1-[4-Methyl-benzoyl]-2-phenyl-ethylidene)-hexahydro-1,3-diazepine
CAS Registry Number 115859-66-0
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C21H24N2O
InChI InChI=1S/C21H24N2O/c1-16-9-11-18(12-10-16)20(24)19(15-17-7-3-2-4-8-17)21-22-13-5-6-14-23-21/h2-4,7-12,22-23H,5-6,13-15H2,1H3
InChIKey AWLQWIRYNGHYAG-UHFFFAOYSA-N
Instrument Name Jeol FX-100
Literature Reference Z. Huang, Z. Liu, Chem. Ber. 112, 95 (1989).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3