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2-(2-Ethoxycarbonyl)-1H-indole-3-yl)-2-methylacetic acid
SpectraBase Compound ID ALoDE6wcZEn
InChI InChI=1S/C14H15NO4/c1-3-19-14(18)12-11(8(2)13(16)17)9-6-4-5-7-10(9)15-12/h4-8,15H,3H2,1-2H3,(H,16,17)
InChIKey NJNHRZOIXLUWND-UHFFFAOYSA-N
Mol Weight 261.28 g/mol
Molecular Formula C14H15NO4
Exact Mass 261.100108 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KOWbJrhVrWa
Name 2-(2-Ethoxycarbonyl)-1H-indole-3-yl)-2-methylacetic acid
Alternate Name(s) 2-(2-ethoxycarbonyl-1H-indol-3-yl)propanoic acid
Comments Less than 3 mono-isotopic peaks
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Formula C14H15NO4
InChI InChI=1S/C14H15NO4/c1-3-19-14(18)12-11(8(2)13(16)17)9-6-4-5-7-10(9)15-12/h4-8,15H,3H2,1-2H3,(H,16,17)
InChIKey NJNHRZOIXLUWND-UHFFFAOYSA-N
Molecular Weight 261.277 g/mol
SMILES [nH]1c2ccccc2c(C(C(=O)O)C)c1C(=O)OCC
SPLASH splash10-00di-0930000000-f937a78190aedebed22f
Source of Spectrum E1-42-450-13
Wiley ID 1552416