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(2S)-2-(benzylamino)-3-[2-(2-keto-2-methoxy-ethyl)-1H-indol-3-yl]propionic acid methyl ester
SpectraBase Compound ID 74sON0YnMu0
InChI InChI=1S/C22H24N2O4/c1-27-21(25)13-19-17(16-10-6-7-11-18(16)24-19)12-20(22(26)28-2)23-14-15-8-4-3-5-9-15/h3-11,20,23-24H,12-14H2,1-2H3/t20-/m0/s1
InChIKey KQZDPMTZSFWKHN-FQEVSTJZSA-N
Mol Weight 380.44 g/mol
Molecular Formula C22H24N2O4
Exact Mass 380.173607 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1k6FPFBWyJZ
Name (2S)-2-(benzylamino)-3-[2-(2-keto-2-methoxy-ethyl)-1H-indol-3-yl]propionic acid methyl ester
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Formula C22H24N2O4
InChI InChI=1S/C22H24N2O4/c1-27-21(25)13-19-17(16-10-6-7-11-18(16)24-19)12-20(22(26)28-2)23-14-15-8-4-3-5-9-15/h3-11,20,23-24H,12-14H2,1-2H3/t20-/m0/s1
InChIKey KQZDPMTZSFWKHN-FQEVSTJZSA-N
Molecular Weight 380.444 g/mol
SMILES [nH]1c2ccccc2c(C[C@@](C(=O)OC)(NCc2ccccc2)[H])c1CC(=O)OC
SPLASH splash10-0udl-5391000000-2fd87334d8ba8a83b701
Source of Spectrum J-63-9430-6
Synonyms (2S)-3-[2-(2-methoxy-2-oxoethyl)-1H-indol-3-yl]-2-[(phenylmethyl)amino]propanoic acid methyl ester Methyl (2S)-2-(benzylamino)-3-[2-(2-methoxy-2-oxo-ethyl)-1H-indol-3-yl]propanoate Methyl (2S)-3-[2-(2-methoxy-2-oxidanylidene-ethyl)-1H-indol-3-yl]-2-[(phenylmethyl)amino]propanoate
Wiley ID 1359820