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N-trifluoroacetyl 3-phenyl-(S)-proline ethyl ester
SpectraBase Compound ID 5HqUyq8tD2r
InChI InChI=1S/C15H16F3NO3/c1-2-22-13(20)12-11(10-6-4-3-5-7-10)8-9-19(12)14(21)15(16,17)18/h3-7,11-12H,2,8-9H2,1H3/t11?,12-/m0/s1
InChIKey KEPYFUZNVKNXDP-KIYNQFGBSA-N
Mol Weight 315.29 g/mol
Molecular Formula C15H16F3NO3
Exact Mass 315.108228 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 32Fzmbghthz
Name N-trifluoroacetyl 3-phenyl-(S)-proline ethyl ester
Alternate Name(s) Ethyl (2S)-3-phenyl-1-(trifluoroacetyl)-2-pyrrolidinecarboxylate
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Formula C15H16F3NO3
InChI InChI=1S/C15H16F3NO3/c1-2-22-13(20)12-11(10-6-4-3-5-7-10)8-9-19(12)14(21)15(16,17)18/h3-7,11-12H,2,8-9H2,1H3/t11?,12-/m0/s1
InChIKey KEPYFUZNVKNXDP-KIYNQFGBSA-N
Molecular Weight 315.292 g/mol
SMILES C(N1[C@@](C(c2ccccc2)CC1)(C(=O)OCC)[H])(C(F)(F)F)=O
SPLASH splash10-0006-0090000000-8bd442bb290cc545181b
Source of Spectrum KC-1988-2082-0
Wiley ID 1315879