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3-(2-aminoethyl)-2-methyl-1H-indole-4,6-dicarboxylic acid

View entire compound with spectra: 1 NMR, and 1 MS (GC)

3-(2-aminoethyl)-2-methyl-1H-indole-4,6-dicarboxylic acid
SpectraBase Compound ID LnIKuxzCbLL
InChI InChI=1S/C13H14N2O4/c1-6-8(2-3-14)11-9(13(18)19)4-7(12(16)17)5-10(11)15-6/h4-5,15H,2-3,14H2,1H3,(H,16,17)(H,18,19)
InChIKey QYTDJNPIPVCDBW-UHFFFAOYSA-N
Mol Weight 262.26 g/mol
Molecular Formula C13H14N2O4
Exact Mass 262.095357 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 1VB27FJYErd
Name 3-(2-ammonioethyl)-6-carboxy-2-methyl-1H-indole-4-carboxylate
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/C13H14N2O4/c1-6-8(2-3-14)11-9(13(18)19)4-7(12(16)17)5-10(11)15-6/h4-5,15H,2-3,14H2,1H3,(H,16,17)(H,18,19)
InChIKey QYTDJNPIPVCDBW-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_ASIOH_7529_4120
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/17231910; Labnumber: TEM-70424