2,4-thiazolidinedione, 5-[[3,5-bis(1,1-dimethylethyl)-4-hydroxyphenyl]methylene]-3-[(4-chlorophenyl)methyl]-, (5Z)-

SpectraBase Compound ID	I39Y30X2ifv
InChI	InChI=1S/C25H28ClNO3S/c1-24(2,3)18-11-16(12-19(21(18)28)25(4,5)6)13-20-22(29)27(23(30)31-20)14-15-7-9-17(26)10-8-15/h7-13,28H,14H2,1-6H3/b20-13-
InChIKey	ZVMFBQGFXMCWII-MOSHPQCFSA-N Google Search
Mol Weight	458.02 g/mol
Molecular Formula	C25H28ClNO3S
Exact Mass	457.147843 g/mol

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SpectraBase Spectrum ID	LhMpuIEBYjW
Name	2,4-thiazolidinedione, 5-[[3,5-bis(1,1-dimethylethyl)-4-hydroxyphenyl]methylene]-3-[(4-chlorophenyl)methyl]-, (5Z)-
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/C25H28ClNO3S/c1-24(2,3)18-11-16(12-19(21(18)28)25(4,5)6)13-20-22(29)27(23(30)31-20)14-15-7-9-17(26)10-8-15/h7-13,28H,14H2,1-6H3/b20-13-
InChIKey	ZVMFBQGFXMCWII-MOSHPQCFSA-N
NMR Offset	18.0068
NMR Spectrometer Frequency	500.134
Observed nucleus	1H
Origin	1H_CB_3517_1782
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: NMR/11229875