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[1,4]dioxino[2,3-g]quinolin-7(6H)-one, 2,3-dihydro-8-[(E)-[3-(4-hydroxyphenyl)-4-oxo-2-thioxo-5-thiazolidinylidene]methyl]-
SpectraBase Compound ID KN3PP3qN9MD
InChI InChI=1S/C21H14N2O5S2/c24-14-3-1-13(2-4-14)23-20(26)18(30-21(23)29)9-12-7-11-8-16-17(28-6-5-27-16)10-15(11)22-19(12)25/h1-4,7-10,24H,5-6H2,(H,22,25)/b18-9+
InChIKey QVSYEDHXTZBTRB-GIJQJNRQSA-N
Mol Weight 438.47 g/mol
Molecular Formula C21H14N2O5S2
Exact Mass 438.034414 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 3csNuigSlG5
Name [1,4]dioxino[2,3-g]quinolin-7(6H)-one, 2,3-dihydro-8-[(E)-[3-(4-hydroxyphenyl)-4-oxo-2-thioxo-5-thiazolidinylidene]methyl]-
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/C21H14N2O5S2/c24-14-3-1-13(2-4-14)23-20(26)18(30-21(23)29)9-12-7-11-8-16-17(28-6-5-27-16)10-15(11)22-19(12)25/h1-4,7-10,24H,5-6H2,(H,22,25)/b18-9+
InChIKey QVSYEDHXTZBTRB-GIJQJNRQSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_11628_2121
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: F14394; Labnumber: EXGOR1-18609