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4-(1H-indol-3-yl)-4-keto-butyric acid ethyl ester
SpectraBase Compound ID 2geYF7wO3ny
InChI InChI=1S/C14H15NO3/c1-2-18-14(17)8-7-13(16)11-9-15-12-6-4-3-5-10(11)12/h3-6,9,15H,2,7-8H2,1H3
InChIKey NBCHRYLOXWMPGS-UHFFFAOYSA-N
Mol Weight 245.28 g/mol
Molecular Formula C14H15NO3
Exact Mass 245.105193 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 557w5Pzetw4
Name 4-(1H-indol-3-yl)-4-keto-butyric acid ethyl ester
Alternate Name(s) 4-(1H-indol-3-yl)-4-oxobutanoic acid ethyl ester Ethyl 4-(1H-indol-3-yl)-4-oxidanylidene-butanoate Ethyl 4-(1H-indol-3-yl)-4-oxo-butanoate
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Formula C14H15NO3
InChI InChI=1S/C14H15NO3/c1-2-18-14(17)8-7-13(16)11-9-15-12-6-4-3-5-10(11)12/h3-6,9,15H,2,7-8H2,1H3
InChIKey NBCHRYLOXWMPGS-UHFFFAOYSA-N
Molecular Weight 245.278 g/mol
SMILES [nH]1c2c(c(c1)C(=O)CCC(=O)OCC)cccc2
SPLASH splash10-0006-2920000000-995d6aa4dbb404039032
Source of Spectrum HC-12-171-0
Wiley ID 1248011