2-[(5E)-5-(4-ethylbenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]ethanesulfonic acid

SpectraBase Compound ID	JRE4ZWSHTjo
InChI	InChI=1S/C14H15NO4S3/c1-2-10-3-5-11(6-4-10)9-12-13(16)15(14(20)21-12)7-8-22(17,18)19/h3-6,9H,2,7-8H2,1H3,(H,17,18,19)/b12-9+
InChIKey	KSZWNNFXNYQMBS-FMIVXFBMSA-N Google Search
Mol Weight	357.46 g/mol
Molecular Formula	C14H15NO4S3
Exact Mass	357.016321 g/mol

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SpectraBase Spectrum ID	L8CkVgdDCmK
Name	2-[(5E)-5-(4-ethylbenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]ethanesulfonic acid
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/C14H15NO4S3/c1-2-10-3-5-11(6-4-10)9-12-13(16)15(14(20)21-12)7-8-22(17,18)19/h3-6,9H,2,7-8H2,1H3,(H,17,18,19)/b12-9+
InChIKey	KSZWNNFXNYQMBS-FMIVXFBMSA-N
NMR Offset	15.5012
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_UBI-VK_18310_6412
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: 123308; Labnumber: EX00117272; VK_ID: VK-006415
Synonyms	2-[5-(4-ethylbenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]ethanesulfonic acid
Temperature	315 °C