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3,5-pyridinedicarbonitrile, 2-amino-4-(4-ethoxyphenyl)-6-[[2-(7-hydroxy-2-oxo-2H-1-benzopyran-3-yl)-2-oxoethyl]thio]-
SpectraBase Compound ID FSeSznRoO2g
InChI InChI=1S/C26H18N4O5S/c1-2-34-17-7-4-14(5-8-17)23-19(11-27)24(29)30-25(20(23)12-28)36-13-21(32)18-9-15-3-6-16(31)10-22(15)35-26(18)33/h3-10,31H,2,13H2,1H3,(H2,29,30)
InChIKey SQTSTZDBLQXYGI-UHFFFAOYSA-N
Mol Weight 498.51 g/mol
Molecular Formula C26H18N4O5S
Exact Mass 498.099791 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID LfG248ksWqe
Name 3,5-pyridinedicarbonitrile, 2-amino-4-(4-ethoxyphenyl)-6-[[2-(7-hydroxy-2-oxo-2H-1-benzopyran-3-yl)-2-oxoethyl]thio]-
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/C26H18N4O5S/c1-2-34-17-7-4-14(5-8-17)23-19(11-27)24(29)30-25(20(23)12-28)36-13-21(32)18-9-15-3-6-16(31)10-22(15)35-26(18)33/h3-10,31H,2,13H2,1H3,(H2,29,30)
InChIKey SQTSTZDBLQXYGI-UHFFFAOYSA-N
NMR Offset 15.0036
NMR Spectrometer Frequency 250.134
Observed nucleus 1H
Origin 1H_CB_8313_1805
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/9223861; Labnumber: DVD-0000008
Temperature 297 °C