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1H-indole-2-carboxylic acid, 5-fluoro-3-[(E)-[3-(4-hydroxyphenyl)-4-oxo-2-thioxo-5-thiazolidinylidene]methyl]-, methyl ester

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1H-indole-2-carboxylic acid, 5-fluoro-3-[(E)-[3-(4-hydroxyphenyl)-4-oxo-2-thioxo-5-thiazolidinylidene]methyl]-, methyl ester
SpectraBase Compound ID AKZzNZxLwtA
InChI InChI=1S/C20H13FN2O4S2/c1-27-19(26)17-14(13-8-10(21)2-7-15(13)22-17)9-16-18(25)23(20(28)29-16)11-3-5-12(24)6-4-11/h2-9,22,24H,1H3/b16-9+
InChIKey USVDPVHBQGESLF-CXUHLZMHSA-N
Mol Weight 428.45 g/mol
Molecular Formula C20H13FN2O4S2
Exact Mass 428.030077 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 9SrhkWGfaBc
Name 1H-indole-2-carboxylic acid, 5-fluoro-3-[(E)-[3-(4-hydroxyphenyl)-4-oxo-2-thioxo-5-thiazolidinylidene]methyl]-, methyl ester
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/C20H13FN2O4S2/c1-27-19(26)17-14(13-8-10(21)2-7-15(13)22-17)9-16-18(25)23(20(28)29-16)11-3-5-12(24)6-4-11/h2-9,22,24H,1H3/b16-9+
InChIKey USVDPVHBQGESLF-CXUHLZMHSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_11628_8995
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: F33950; Labnumber: EXGOR1-18784