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(1R,5S)-3-(5-bromobenzofuran-2-carbonyl)-3,4,5,6-tetrahydro-1H-1,5-methanopyrido[1,2-a][1,5]diazocin-8(2H)-one
SpectraBase Compound ID 4mZIfqy7bgW
InChI InChI=1S/C20H17BrN2O3/c21-15-4-5-17-13(7-15)8-18(26-17)20(25)22-9-12-6-14(11-22)16-2-1-3-19(24)23(16)10-12/h1-5,7-8,12,14H,6,9-11H2
InChIKey WCNWARYSICKKGF-UHFFFAOYSA-N
Mol Weight 413.27 g/mol
Molecular Formula C20H17BrN2O3
Exact Mass 412.042255 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Ah1M2qDHLbM
Name (1R,5S)-3-(5-bromobenzofuran-2-carbonyl)-3,4,5,6-tetrahydro-1H-1,5-methanopyrido[1,2-a][1,5]diazocin-8(2H)-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/C20H17BrN2O3/c21-15-4-5-17-13(7-15)8-18(26-17)20(25)22-9-12-6-14(11-22)16-2-1-3-19(24)23(16)10-12/h1-5,7-8,12,14H,6,9-11H2
InChIKey WCNWARYSICKKGF-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_11628_1145
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: F07531; Labnumber: ExLab-131634