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(Z)-3-isopentyl-5-(((1R,5S)-8-oxo-5,6-dihydro-1H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(2H,4H,8H)-yl)methylene)-2-thioxothiazolidin-4-one

View entire compound with spectra: 1 NMR

(Z)-3-isopentyl-5-(((1R,5S)-8-oxo-5,6-dihydro-1H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(2H,4H,8H)-yl)methylene)-2-thioxothiazolidin-4-one
SpectraBase Compound ID EqwqY2osx83
InChI InChI=1S/C20H25N3O2S2/c1-13(2)6-7-22-19(25)17(27-20(22)26)12-21-9-14-8-15(11-21)16-4-3-5-18(24)23(16)10-14/h3-5,12-15H,6-11H2,1-2H3/b17-12-
InChIKey AMXRKWNJBSHPDX-ATVHPVEESA-N
Mol Weight 403.56 g/mol
Molecular Formula C20H25N3O2S2
Exact Mass 403.138819 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID C2iYxwVIQZj
Name (Z)-3-isopentyl-5-(((1R,5S)-8-oxo-5,6-dihydro-1H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(2H,4H,8H)-yl)methylene)-2-thioxothiazolidin-4-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/C20H25N3O2S2/c1-13(2)6-7-22-19(25)17(27-20(22)26)12-21-9-14-8-15(11-21)16-4-3-5-18(24)23(16)10-14/h3-5,12-15H,6-11H2,1-2H3/b17-12-
InChIKey AMXRKWNJBSHPDX-ATVHPVEESA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_11628_6150
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: F27343; Labnumber: ExLab-217240