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4-(3,3-dimethyl-1-oxo-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-11-yl)phenyl 4-chlorobenzoate
SpectraBase Compound ID LdEeqs6ybOi
InChI InChI=1S/C28H25ClN2O3/c1-28(2)15-23-25(24(32)16-28)26(31-22-6-4-3-5-21(22)30-23)17-9-13-20(14-10-17)34-27(33)18-7-11-19(29)12-8-18/h3-14,26,30-31H,15-16H2,1-2H3
InChIKey QCJMGZGCMSFQIY-UHFFFAOYSA-N
Mol Weight 472.97 g/mol
Molecular Formula C28H25ClN2O3
Exact Mass 472.15537 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID KPtMcpLnO7p
Name 4-(3,3-dimethyl-1-oxo-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-11-yl)phenyl 4-chlorobenzoate
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/C28H25ClN2O3/c1-28(2)15-23-25(24(32)16-28)26(31-22-6-4-3-5-21(22)30-23)17-9-13-20(14-10-17)34-27(33)18-7-11-19(29)12-8-18/h3-14,26,30-31H,15-16H2,1-2H3
InChIKey QCJMGZGCMSFQIY-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_3145
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: D09096; Labnumber: VGU-17365; SBI_ID: SBI-003147
Temperature 315 °C