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(S)-Ethyl 2-amino-3, 3, 3-trifluoro-2-(1H-indol-3-yl)propanoate
SpectraBase Compound ID G8RmqtAUGdP
InChI InChI=1S/C13H13F3N2O2/c1-2-20-11(19)12(17,13(14,15)16)9-7-18-10-6-4-3-5-8(9)10/h3-7,18H,2,17H2,1H3/t12-/m0/s1
InChIKey BESVJAAMVQYJDM-LBPRGKRZSA-N
Mol Weight 286.25 g/mol
Molecular Formula C13H13F3N2O2
Exact Mass 286.092912 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JoKt3uJ3CuB
Name (S)-Ethyl 2-amino-3, 3, 3-trifluoro-2-(1H-indol-3-yl)propanoate
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Formula C13H13F3N2O2
InChI InChI=1S/C13H13F3N2O2/c1-2-20-11(19)12(17,13(14,15)16)9-7-18-10-6-4-3-5-8(9)10/h3-7,18H,2,17H2,1H3/t12-/m0/s1
InChIKey BESVJAAMVQYJDM-LBPRGKRZSA-N
Literature Reference DOI 10.1002/cmdc.201100569
Molecular Weight 286.254 g/mol
SMILES [nH]1cc([C@](C(F)(F)F)(N)C(OCC)=O)c2c1cccc2
SPLASH splash10-03xr-1790000000-e63efa7f38d01cf7d695
Source of Spectrum CMC-7-910/SM27-88(S)
Synonyms (S)-ethyl 2-amino-3,3,3-trifluoro-2-(1H-indol-3-yl)propanoate
Wiley ID 1771836