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(5Z)-1,4-dimethyl-2,6-dioxo-5-{[(2-oxo-2,3-dihydro-1H-benzimidazol-5-yl)amino]methylene}-1,2,5,6-tetrahydro-3-pyridinecarbonitrile
SpectraBase Compound ID HhPAcE541xB
InChI InChI=1S/C16H13N5O3/c1-8-10(6-17)14(22)21(2)15(23)11(8)7-18-9-3-4-12-13(5-9)20-16(24)19-12/h3-5,7,18H,1-2H3,(H2,19,20,24)/b11-7-
InChIKey CQWKXXBXIBDJCW-XFFZJAGNSA-N
Mol Weight 323.31 g/mol
Molecular Formula C16H13N5O3
Exact Mass 323.101839 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID JFyVlfSCJj0
Name (5Z)-1,4-dimethyl-2,6-dioxo-5-{[(2-oxo-2,3-dihydro-1H-benzimidazol-5-yl)amino]methylene}-1,2,5,6-tetrahydro-3-pyridinecarbonitrile
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/C16H13N5O3/c1-8-10(6-17)14(22)21(2)15(23)11(8)7-18-9-3-4-12-13(5-9)20-16(24)19-12/h3-5,7,18H,1-2H3,(H2,19,20,24)/b11-7-
InChIKey CQWKXXBXIBDJCW-XFFZJAGNSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_2887
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: UZI/8069475; UBI_ID: UBI-002888
Synonyms 1,4-dimethyl-2,6-dioxo-5-{[(2-oxo-2,3-dihydro-1H-benzimidazol-5-yl)amino]methylene}-1,2,5,6-tetrahydro-3-pyridinecarbonitrile
Temperature 308 °C