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(S)-6-Chloro-5-hydroxytryptophan Ethyl Ester
SpectraBase Compound ID EfMcPVWgX0g
InChI InChI=1S/C13H15ClN2O3/c1-2-19-13(18)10(15)3-7-6-16-11-5-9(14)12(17)4-8(7)11/h4-6,10,16-17H,2-3,15H2,1H3/t10-/m0/s1
InChIKey LXWTZRAJUGOSSX-JTQLQIEISA-N
Mol Weight 282.73 g/mol
Molecular Formula C13H15ClN2O3
Exact Mass 282.07712 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1vwYHSNWFws
Name (S)-6-Chloro-5-hydroxytryptophan Ethyl Ester
Alternate Name(s) Ethyl (2S)-2-amino-3-(6-chloro-5-hydroxy-1H-indol-3-yl)propanoate
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Formula C13H15ClN2O3
InChI InChI=1S/C13H15ClN2O3/c1-2-19-13(18)10(15)3-7-6-16-11-5-9(14)12(17)4-8(7)11/h4-6,10,16-17H,2-3,15H2,1H3/t10-/m0/s1
InChIKey LXWTZRAJUGOSSX-JTQLQIEISA-N
Molecular Weight 282.727 g/mol
SMILES Oc1c(cc2c(c(C[C@@](C(=O)OCC)(N)[H])c[nH]2)c1)Cl
SPLASH splash10-001i-0910000000-4494fa8d79d30a93f500
Source of Spectrum J-62-7454-21
Wiley ID 1285487