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3-(1,2-DIMETHYL-INDOL-3-YL)-PROPIONIC-ACID

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3-(1,2-DIMETHYL-INDOL-3-YL)-PROPIONIC-ACID
SpectraBase Compound ID DFEYGhErYlG
InChI InChI=1S/C13H15NO2/c1-9-10(7-8-13(15)16)11-5-3-4-6-12(11)14(9)2/h3-6H,7-8H2,1-2H3,(H,15,16)
InChIKey HECVMOZJLQZOLF-UHFFFAOYSA-N
Mol Weight 217.27 g/mol
Molecular Formula C13H15NO2
Exact Mass 217.110279 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4WbLLKVqnkZ
Name 3-(1,2-DIMETHYL-INDOL-3-YL)-PROPIONIC-ACID
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H15NO2
InChI InChI=1S/C13H15NO2/c1-9-10(7-8-13(15)16)11-5-3-4-6-12(11)14(9)2/h3-6H,7-8H2,1-2H3,(H,15,16)
InChIKey HECVMOZJLQZOLF-UHFFFAOYSA-N
Literature Reference Author K.THIEME,I.SCHNELL
Literature Reference Citation J.AM.CHEM.SOC.,125,12100(2003)
Literature Reference DOI 10.1021/ja037374n
Molecular Weight 217.268 g/mol
Sample ID 50564
Solvent CDCl3