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1H-dibenzo[b,e][1,4]diazepin-1-one, 3-(2-chlorophenyl)-2,3,4,5,10,11-hexahydro-11-[4-(trifluoromethoxy)phenyl]-
SpectraBase Compound ID 8sU2uzAgZgf
InChI InChI=1S/C26H20ClF3N2O2/c27-19-6-2-1-5-18(19)16-13-22-24(23(33)14-16)25(32-21-8-4-3-7-20(21)31-22)15-9-11-17(12-10-15)34-26(28,29)30/h1-12,16,25,31-32H,13-14H2
InChIKey AYLWUJRGKZVCLK-UHFFFAOYSA-N
Mol Weight 484.91 g/mol
Molecular Formula C26H20ClF3N2O2
Exact Mass 484.11654 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID JZyw5S0qAtZ
Name 1H-dibenzo[b,e][1,4]diazepin-1-one, 3-(2-chlorophenyl)-2,3,4,5,10,11-hexahydro-11-[4-(trifluoromethoxy)phenyl]-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 484.116540079 u
Formula C26H20ClF3N2O2
InChI InChI=1S/C26H20ClF3N2O2/c27-19-6-2-1-5-18(19)16-13-22-24(23(33)14-16)25(32-21-8-4-3-7-20(21)31-22)15-9-11-17(12-10-15)34-26(28,29)30/h1-12,16,25,31-32H,13-14H2
InChIKey AYLWUJRGKZVCLK-UHFFFAOYSA-N
Molecular Weight 484.906 g/mol
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_9364
Solvent DMSO-d6
Source Vendor ID: NMR/10240516; Lab Info: SAS; Lab Number: SAS-tst3704
Temperature 29.85 °C