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3-(3,4-dimethoxyphenyl)-11-(3-thienyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
SpectraBase Compound ID Gw7cDfpVVxx
InChI InChI=1S/C25H24N2O3S/c1-29-22-8-7-15(13-23(22)30-2)17-11-20-24(21(28)12-17)25(16-9-10-31-14-16)27-19-6-4-3-5-18(19)26-20/h3-10,13-14,17,25-27H,11-12H2,1-2H3
InChIKey ONWRRUVUXMKAKW-UHFFFAOYSA-N
Mol Weight 432.54 g/mol
Molecular Formula C25H24N2O3S
Exact Mass 432.150764 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 6Onos52YxVc
Name 3-(3,4-dimethoxyphenyl)-11-(3-thienyl)-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/C25H24N2O3S/c1-29-22-8-7-15(13-23(22)30-2)17-11-20-24(21(28)12-17)25(16-9-10-31-14-16)27-19-6-4-3-5-18(19)26-20/h3-10,13-14,17,25-27H,11-12H2,1-2H3
InChIKey ONWRRUVUXMKAKW-UHFFFAOYSA-N
NMR Offset 16.0087
NMR Spectrometer Frequency 500.133
Observed nucleus 1H
Origin 1H_ASIOH_7529_2414
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/9312173; Labnumber: SAS-tst3144