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[5-methoxy-1-methyl-3-(methylsulfanyl)-1H-indol-2-yl]acetic acid
SpectraBase Compound ID zrbGAKwzmN
InChI InChI=1S/C13H15NO3S/c1-14-10-5-4-8(17-2)6-9(10)13(18-3)11(14)7-12(15)16/h4-6H,7H2,1-3H3,(H,15,16)
InChIKey YAKRJZZTHCGRCY-UHFFFAOYSA-N
Mol Weight 265.33 g/mol
Molecular Formula C13H15NO3S
Exact Mass 265.077265 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Fuu7ar4OTV8
Name [5-methoxy-1-methyl-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/C13H15NO3S/c1-14-10-5-4-8(17-2)6-9(10)13(18-3)11(14)7-12(15)16/h4-6H,7H2,1-3H3,(H,15,16)
InChIKey YAKRJZZTHCGRCY-UHFFFAOYSA-N
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_ASIOH_7000_91
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: NMR/8255294; Labnumber: JMR-0001541; IOH_ID: IOH-000092
Temperature 303 °C