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1H-dibenzo[b,e][1,4]diazepin-1-one, 3-(4-chlorophenyl)-2,3,4,5,10,11-hexahydro-11-(4-nitrophenyl)-
SpectraBase Compound ID KVRGDfaeqdU
InChI InChI=1S/C25H20ClN3O3/c26-18-9-5-15(6-10-18)17-13-22-24(23(30)14-17)25(16-7-11-19(12-8-16)29(31)32)28-21-4-2-1-3-20(21)27-22/h1-12,17,25,27-28H,13-14H2
InChIKey SMJGNOKPHVFSNP-UHFFFAOYSA-N
Mol Weight 445.91 g/mol
Molecular Formula C25H20ClN3O3
Exact Mass 445.119319 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 1Kb9pQmjTws
Name 1H-dibenzo[b,e][1,4]diazepin-1-one, 3-(4-chlorophenyl)-2,3,4,5,10,11-hexahydro-11-(4-nitrophenyl)-
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C25H20ClN3O3/c26-18-9-5-15(6-10-18)17-13-22-24(23(30)14-17)25(16-7-11-19(12-8-16)29(31)32)28-21-4-2-1-3-20(21)27-22/h1-12,17,25,27-28H,13-14H2
InChIKey SMJGNOKPHVFSNP-UHFFFAOYSA-N
NMR Offset 16.0087
NMR Spectrometer Frequency 500.133
Observed nucleus 1H
Origin 1H_CB_8313_5859
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: NMR/9312147; Labnumber: SAS-tst3118