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3-thiazolidinehexanoic acid, 5-[(5,6-dihydro-6-oxo[1,3]dioxolo[4,5-g]quinolin-7-yl)methylene]-4-oxo-2-thioxo-, (5E)-
SpectraBase Compound ID EAZ7xUU7FTS
InChI InChI=1S/C20H18N2O6S2/c23-17(24)4-2-1-3-5-22-19(26)16(30-20(22)29)8-12-6-11-7-14-15(28-10-27-14)9-13(11)21-18(12)25/h6-9H,1-5,10H2,(H,21,25)(H,23,24)/b16-8+
InChIKey CHYVVHRXBWZFDI-LZYBPNLTSA-N
Mol Weight 446.49 g/mol
Molecular Formula C20H18N2O6S2
Exact Mass 446.060629 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 6vvOjhkPsZE
Name 3-thiazolidinehexanoic acid, 5-[(5,6-dihydro-6-oxo[1,3]dioxolo[4,5-g]quinolin-7-yl)methylene]-4-oxo-2-thioxo-, (5E)-
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/C20H18N2O6S2/c23-17(24)4-2-1-3-5-22-19(26)16(30-20(22)29)8-12-6-11-7-14-15(28-10-27-14)9-13(11)21-18(12)25/h6-9H,1-5,10H2,(H,21,25)(H,23,24)/b16-8+
InChIKey CHYVVHRXBWZFDI-LZYBPNLTSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_11628_2127
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: F14402; Labnumber: EXGOR1-18948