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2-chloro-6-methoxy-4-[(Z)-(4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]phenyl benzenesulfonate
SpectraBase Compound ID 9ODoK8VXXr
InChI InChI=1S/C17H12ClNO5S3/c1-23-13-8-10(9-14-16(20)19-17(25)26-14)7-12(18)15(13)24-27(21,22)11-5-3-2-4-6-11/h2-9H,1H3,(H,19,20,25)/b14-9-
InChIKey RNOFNOIDDDANBJ-ZROIWOOFSA-N
Mol Weight 441.92 g/mol
Molecular Formula C17H12ClNO5S3
Exact Mass 440.956614 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID HEi4kQNu0Lx
Name 2-chloro-6-methoxy-4-[(Z)-(4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]phenyl benzenesulfonate
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/C17H12ClNO5S3/c1-23-13-8-10(9-14-16(20)19-17(25)26-14)7-12(18)15(13)24-27(21,22)11-5-3-2-4-6-11/h2-9H,1H3,(H,19,20,25)/b14-9-
InChIKey RNOFNOIDDDANBJ-ZROIWOOFSA-N
NMR Offset 16.0772
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_8207
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/1009133; UBI_ID: UBI-008210
Synonyms 2-chloro-6-methoxy-4-[(4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]phenyl benzenesulfonate
Temperature 308 °C