6-Bromo-1-cyclohexyl-5-hydroxy-2-[(phenylthio)methyl]-3-indolecarboxylic acid ethyl ester

SpectraBase Compound ID	CtErdNCmcFd
InChI	InChI=1S/C24H26BrNO3S/c1-2-29-24(28)23-18-13-22(27)19(25)14-20(18)26(16-9-5-3-6-10-16)21(23)15-30-17-11-7-4-8-12-17/h4,7-8,11-14,16,27H,2-3,5-6,9-10,15H2,1H3
InChIKey	OKHZCIFCEKTVHO-UHFFFAOYSA-N Google Search
Mol Weight	488.44 g/mol
Molecular Formula	C24H26BrNO3S
Exact Mass	487.081678 g/mol

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SpectraBase Spectrum ID	Fncxgvalkq
Name	1H-indole-3-carboxylic acid, 6-bromo-1-cyclohexyl-5-hydroxy-2-[(phenylthio)methyl]-, ethyl ester
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/C24H26BrNO3S/c1-2-29-24(28)23-18-13-22(27)19(25)14-20(18)26(16-9-5-3-6-10-16)21(23)15-30-17-11-7-4-8-12-17/h4,7-8,11-14,16,27H,2-3,5-6,9-10,15H2,1H3
InChIKey	OKHZCIFCEKTVHO-UHFFFAOYSA-N
NMR Offset	15.0036
NMR Spectrometer Frequency	250.134
Observed nucleus	1H
Origin	1H_ASIOH_8516_3231
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: ZI/6055239; Labnumber: JMR-0374; IOH_ID: IOH-010234
Temperature	297 °C