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1H-dibenzo[b,e][1,4]diazepin-1-one, 7-benzoyl-2,3,4,5,10,11-hexahydro-3,3-dimethyl-11-[4-(methylthio)phenyl]-
SpectraBase Compound ID JtIeKRiFBww
InChI InChI=1S/C29H28N2O2S/c1-29(2)16-24-26(25(32)17-29)27(18-9-12-21(34-3)13-10-18)31-22-14-11-20(15-23(22)30-24)28(33)19-7-5-4-6-8-19/h4-15,27,30-31H,16-17H2,1-3H3
InChIKey WRHWVTLMQLHNSV-UHFFFAOYSA-N
Mol Weight 468.62 g/mol
Molecular Formula C29H28N2O2S
Exact Mass 468.187149 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 49BXRm23Jr9
Name 1H-dibenzo[b,e][1,4]diazepin-1-one, 7-benzoyl-2,3,4,5,10,11-hexahydro-3,3-dimethyl-11-[4-(methylthio)phenyl]-
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/C29H28N2O2S/c1-29(2)16-24-26(25(32)17-29)27(18-9-12-21(34-3)13-10-18)31-22-14-11-20(15-23(22)30-24)28(33)19-7-5-4-6-8-19/h4-15,27,30-31H,16-17H2,1-3H3
InChIKey WRHWVTLMQLHNSV-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB_8313_7643
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/10329495