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3-(2-Aminoethyl)-5-methyl-1H-indole-2-carboxylic acid
SpectraBase Compound ID FQ1XCgYx1v2
InChI InChI=1S/C12H14N2O2/c1-7-2-3-10-9(6-7)8(4-5-13)11(14-10)12(15)16/h2-3,6,14H,4-5,13H2,1H3,(H,15,16)
InChIKey NTLCAYJXMCPSMD-UHFFFAOYSA-N
Mol Weight 218.26 g/mol
Molecular Formula C12H14N2O2
Exact Mass 218.105528 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3h2ocJT5AuX
Name 3-(2-Aminoethyl)-5-methyl-1H-indole-2-carboxylic acid
Alternate Name(s) 3-(2-ammonioethyl)-5-methyl-1H-indole-2-carboxylate 3-(2-azaniumylethyl)-5-methyl-1H-indole-2-carboxylate 3-(2-azanylethyl)-5-methyl-1H-indole-2-carboxylic acid
CAS Registry Number 104510-00-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H14N2O2
InChI InChI=1S/C12H14N2O2/c1-7-2-3-10-9(6-7)8(4-5-13)11(14-10)12(15)16/h2-3,6,14H,4-5,13H2,1H3,(H,15,16)
InChIKey NTLCAYJXMCPSMD-UHFFFAOYSA-N
Molecular Weight 218.256 g/mol
SMILES [nH]1c(c(CCN)c2c1ccc(c2)C)C(O)=O
SPLASH splash10-00du-5900000000-de43555a0b7ead482150
Source of Spectrum AD-0-2532-0
Wiley ID 1421519