[1-benzyl-3-(methylsulfanyl)-1H-indol-2-yl]acetic acid

SpectraBase Compound ID	5AOETHzaoiF
InChI	InChI=1S/C18H17NO2S/c1-22-18-14-9-5-6-10-15(14)19(16(18)11-17(20)21)12-13-7-3-2-4-8-13/h2-10H,11-12H2,1H3,(H,20,21)
InChIKey	ZNRFHFNEYSLUQB-UHFFFAOYSA-N Google Search
Mol Weight	311.4 g/mol
Molecular Formula	C18H17NO2S
Exact Mass	311.098 g/mol

View the Full Spectrum for FREE!

SpectraBase Spectrum ID	ANhuIpvC7Ky
Name	[1-benzyl-3-(methylsulfanyl)-1H-indol-2-yl]acetic 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/C18H17NO2S/c1-22-18-14-9-5-6-10-15(14)19(16(18)11-17(20)21)12-13-7-3-2-4-8-13/h2-10H,11-12H2,1H3,(H,20,21)
InChIKey	ZNRFHFNEYSLUQB-UHFFFAOYSA-N
NMR Offset	18.0059
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_ASIOH_7000_3538
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/7071916; Labnumber: JMR-0001270; IOH_ID: IOH-003539
Temperature	303 °C