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3-(3,4-dimethoxyphenyl)-11-(4-pyridinyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
SpectraBase Compound ID 6Osn406jE5Y
InChI InChI=1S/C26H25N3O3/c1-31-23-8-7-17(15-24(23)32-2)18-13-21-25(22(30)14-18)26(16-9-11-27-12-10-16)29-20-6-4-3-5-19(20)28-21/h3-12,15,18,26,28-29H,13-14H2,1-2H3
InChIKey YSPATPBMNCXEOI-UHFFFAOYSA-N
Mol Weight 427.5 g/mol
Molecular Formula C26H25N3O3
Exact Mass 427.189592 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID CEOFcctvMIR
Name 3-(3,4-dimethoxyphenyl)-11-(4-pyridinyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
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/C26H25N3O3/c1-31-23-8-7-17(15-24(23)32-2)18-13-21-25(22(30)14-18)26(16-9-11-27-12-10-16)29-20-6-4-3-5-19(20)28-21/h3-12,15,18,26,28-29H,13-14H2,1-2H3
InChIKey YSPATPBMNCXEOI-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_13337
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: UZI/9120434; UBI_ID: UBI-013340
Temperature 308 °C