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(1-Benzyl-1H-indol-3-ylsulfanyl)-acetic acid

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(1-Benzyl-1H-indol-3-ylsulfanyl)-acetic acid
SpectraBase Compound ID KaSOtPZTWII
InChI InChI=1S/C17H15NO2S/c19-17(20)12-21-16-11-18(10-13-6-2-1-3-7-13)15-9-5-4-8-14(15)16/h1-9,11H,10,12H2,(H,19,20)
InChIKey AWNSSDYXGNZKMK-UHFFFAOYSA-N
Mol Weight 297.37 g/mol
Molecular Formula C17H15NO2S
Exact Mass 297.08235 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID KURBRL8YQI
Name acetic acid, [[1-(phenylmethyl)-1H-indol-3-yl]thio]-
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/C17H15NO2S/c19-17(20)12-21-16-11-18(10-13-6-2-1-3-7-13)15-9-5-4-8-14(15)16/h1-9,11H,10,12H2,(H,19,20)
InChIKey AWNSSDYXGNZKMK-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_ASIOH_8516_7729
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: ZERO/001800; IOH_ID: IOH-014734