(5Z)-5-[4-(octyloxy)benzylidene]-3-(2-phenylethyl)-2-thioxo-1,3-thiazolidin-4-one

SpectraBase Compound ID	7sBGBHP5gEm
InChI	InChI=1S/C26H31NO2S2/c1-2-3-4-5-6-10-19-29-23-15-13-22(14-16-23)20-24-25(28)27(26(30)31-24)18-17-21-11-8-7-9-12-21/h7-9,11-16,20H,2-6,10,17-19H2,1H3/b24-20-
InChIKey	NYMKBNPUZUQIKH-GFMRDNFCSA-N Google Search
Mol Weight	453.66 g/mol
Molecular Formula	C26H31NO2S2
Exact Mass	453.179622 g/mol

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SpectraBase Spectrum ID	4M6om5NXQt2
Name	(5Z)-5-[4-(octyloxy)benzylidene]-3-(2-phenylethyl)-2-thioxo-1,3-thiazolidin-4-one
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/C26H31NO2S2/c1-2-3-4-5-6-10-19-29-23-15-13-22(14-16-23)20-24-25(28)27(26(30)31-24)18-17-21-11-8-7-9-12-21/h7-9,11-16,20H,2-6,10,17-19H2,1H3/b24-20-
InChIKey	NYMKBNPUZUQIKH-GFMRDNFCSA-N
NMR Offset	15.328
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_36227_23770
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: D43296; Labnumber: GORPS-056-3695; SBI_ID: SBI-023774
Synonyms	5-[4-(octyloxy)benzylidene]-3-(2-phenylethyl)-2-thioxo-1,3-thiazolidin-4-one
Temperature	318 °C