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1H-dibenzo[b,e][1,4]diazepin-1-one, 3-(4-chlorophenyl)-11-[4-(dimethylamino)phenyl]-2,3,4,5,10,11-hexahydro-
SpectraBase Compound ID 6M2HgXO6xtR
InChI InChI=1S/C27H26ClN3O/c1-31(2)21-13-9-18(10-14-21)27-26-24(29-22-5-3-4-6-23(22)30-27)15-19(16-25(26)32)17-7-11-20(28)12-8-17/h3-14,19,27,29-30H,15-16H2,1-2H3
InChIKey UXBLMKHKNIFXDS-UHFFFAOYSA-N
Mol Weight 443.98 g/mol
Molecular Formula C27H26ClN3O
Exact Mass 443.17644 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID FnW3RBhIbpG
Name 1H-dibenzo[b,e][1,4]diazepin-1-one, 3-(4-chlorophenyl)-11-[4-(dimethylamino)phenyl]-2,3,4,5,10,11-hexahydro-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 443.176440168 u
Formula C27H26ClN3O
InChI InChI=1S/C27H26ClN3O/c1-31(2)21-13-9-18(10-14-21)27-26-24(29-22-5-3-4-6-23(22)30-27)15-19(16-25(26)32)17-7-11-20(28)12-8-17/h3-14,19,27,29-30H,15-16H2,1-2H3
InChIKey UXBLMKHKNIFXDS-UHFFFAOYSA-N
Molecular Weight 443.978 g/mol
NMR Offset 15.0036
NMR Spectrometer Frequency 250.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_2317
Solvent DMSO-d6
Source Vendor ID: NMR/9213352; Lab Info: SAS; Lab Number: SAS-TST0609
Temperature 23.85 °C