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2-(2-acetyl-1H-indol-3-yl)acetic acid
SpectraBase Compound ID 4VYz0E38PMs
InChI InChI=1S/C12H11NO3/c1-7(14)12-9(6-11(15)16)8-4-2-3-5-10(8)13-12/h2-5,13H,6H2,1H3,(H,15,16)
InChIKey FRORHXIYZWBJHA-UHFFFAOYSA-N
Mol Weight 217.22 g/mol
Molecular Formula C12H11NO3
Exact Mass 217.073893 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 741uZenAUfC
Name 2-(2-acetyl-1H-indol-3-yl)acetic acid
Alternate Name(s) 2-(2-Ethanoyl-1H-indol-3-yl)ethanoic acid
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Formula C12H11NO3
InChI InChI=1S/C12H11NO3/c1-7(14)12-9(6-11(15)16)8-4-2-3-5-10(8)13-12/h2-5,13H,6H2,1H3,(H,15,16)
InChIKey FRORHXIYZWBJHA-UHFFFAOYSA-N
Molecular Weight 217.224 g/mol
SMILES [nH]1c2c(c(CC(=O)O)c1C(=O)C)cccc2
SPLASH splash10-00xr-0970000000-3d761252e5b6c3b737b5
Source of Spectrum Y-29-147-2
Wiley ID 1216559