(2E)-3-(4-{4-[(4-isopropylphenyl)sulfanyl]butoxy}-3-methoxyphenyl)-2-propenoic acid

SpectraBase Compound ID	LO3SvbwTTl4
InChI	InChI=1S/C23H28O4S/c1-17(2)19-8-10-20(11-9-19)28-15-5-4-14-27-21-12-6-18(7-13-23(24)25)16-22(21)26-3/h6-13,16-17H,4-5,14-15H2,1-3H3,(H,24,25)/b13-7+
InChIKey	PSBKNODGJKPGCY-NTUHNPAUSA-N Google Search
Mol Weight	400.53 g/mol
Molecular Formula	C23H28O4S
Exact Mass	400.170831 g/mol

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SpectraBase Spectrum ID	FruTNCaWy1V
Name	(2E)-3-(4-{4-[(4-isopropylphenyl)sulfanyl]butoxy}-3-methoxyphenyl)-2-propenoic 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/C23H28O4S/c1-17(2)19-8-10-20(11-9-19)28-15-5-4-14-27-21-12-6-18(7-13-23(24)25)16-22(21)26-3/h6-13,16-17H,4-5,14-15H2,1-3H3,(H,24,25)/b13-7+
InChIKey	PSBKNODGJKPGCY-NTUHNPAUSA-N
NMR Offset	15.328
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_UBI-VK_18310_17572
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: 987/00005797; Labnumber: 987/00005797218871; VK_ID: VK-017577
Synonyms	3-(4-{4-[(4-isopropylphenyl)sulfanyl]butoxy}-3-methoxyphenyl)-2-propenoic acid
Temperature	318 °C