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3-[(3S)-3-ethyl-1-[2-(1H-indol-3-yl)ethyl]-2-keto-3-piperidyl]propionic acid methyl ester
SpectraBase Compound ID I5LaTynTgq2
InChI InChI=1S/C21H28N2O3/c1-3-21(12-9-19(24)26-2)11-6-13-23(20(21)25)14-10-16-15-22-18-8-5-4-7-17(16)18/h4-5,7-8,15,22H,3,6,9-14H2,1-2H3/t21-/m0/s1
InChIKey HELRCYZOHARJJR-NRFANRHFSA-N
Mol Weight 356.47 g/mol
Molecular Formula C21H28N2O3
Exact Mass 356.209993 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1LylrfuLGeC
Name 3-[(3S)-3-ethyl-1-[2-(1H-indol-3-yl)ethyl]-2-keto-3-piperidyl]propionic acid methyl ester
Alternate Name(s) 3-[(3S)-3-ethyl-1-[2-(1H-indol-3-yl)ethyl]-2-oxo-3-piperidinyl]propanoic acid methyl ester Methyl 3-[(3S)-3-ethyl-1-[2-(1H-indol-3-yl)ethyl]-2-oxidanylidene-piperidin-3-yl]propanoate Methyl 3-[(3S)-3-ethyl-1-[2-(1H-indol-3-yl)ethyl]-2-oxo-3-piperidyl]propanoate Methyl 3-[(3S)-3-ethyl-1-[2-(1H-indol-3-yl)ethyl]-2-oxopiperidin-3-yl]propanoate
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Formula C21H28N2O3
InChI InChI=1S/C21H28N2O3/c1-3-21(12-9-19(24)26-2)11-6-13-23(20(21)25)14-10-16-15-22-18-8-5-4-7-17(16)18/h4-5,7-8,15,22H,3,6,9-14H2,1-2H3/t21-/m0/s1
InChIKey HELRCYZOHARJJR-NRFANRHFSA-N
Molecular Weight 356.466 g/mol
SMILES [nH]1c2c(c(c1)CCN1C([C@](CCC(=O)OC)(CCC1)CC)=O)cccc2
SPLASH splash10-0006-0900000000-7416a136add91f4c22f8
Source of Spectrum J-62-3900-38
Wiley ID 1345967