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N-TFA-L-prolyl-gamma-aminobutyric acid butyl ester
SpectraBase Compound ID 44JZAlbAQRG
InChI InChI=1S/C15H23F3N2O4/c1-2-3-9-24-13(22)10(6-7-19)12(21)11-5-4-8-20(11)14(23)15(16,17)18/h10-11H,2-9,19H2,1H3/t10?,11-/m0/s1
InChIKey VNGZKSLPRHRBDA-DTIOYNMSSA-N
Mol Weight 352.35 g/mol
Molecular Formula C15H23F3N2O4
Exact Mass 352.160992 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EXxBKogjN4M
Name N-TFA-L-prolyl-gamma-aminobutyric acid butyl ester
Alternate Name(s) Butyl 4-amino-2-{[(2S)-1-(trifluoroacetyl)pyrrolidinyl]carbonyl}butanoate N-TFA-L-prolyl-.gamma.-aminobutyric acid butyl ester
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Formula C15H23F3N2O4
InChI InChI=1S/C15H23F3N2O4/c1-2-3-9-24-13(22)10(6-7-19)12(21)11-5-4-8-20(11)14(23)15(16,17)18/h10-11H,2-9,19H2,1H3/t10?,11-/m0/s1
InChIKey VNGZKSLPRHRBDA-DTIOYNMSSA-N
Molecular Weight 352.354 g/mol
SMILES NCCC(C([C@]1(N(C(C(F)(F)F)=O)CCC1)[H])=O)C(=O)OCCCC
SPLASH splash10-014i-4900000000-d4084ec278f9b736ea0b
Source of Spectrum W5-1989-9643-1
Wiley ID 1342985