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N-trifluoroacetyl 3-phenyl-(S)-proline trans-ethyl ester
SpectraBase Compound ID 7He7ALJp2A5
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+/m1/s1
InChIKey KEPYFUZNVKNXDP-NEPJUHHUSA-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 w5pRBwxFVV
Name N-trifluoroacetyl 3-phenyl-(S)-proline trans-ethyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
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+/m1/s1
InChIKey KEPYFUZNVKNXDP-NEPJUHHUSA-N
Molecular Weight 315.292 g/mol
SMILES C(N1[C@@]([C@@](c2ccccc2)(CC1)[H])(C(=O)OCC)[H])(C(F)(F)F)=O
SPLASH splash10-0006-0090000000-88f518ecaf291b8eb608
Source of Spectrum KC-1988-2081-0
Synonyms Ethyl (2S,3R)-3-phenyl-1-(trifluoroacetyl)-2-pyrrolidinecarboxylate
Wiley ID 1315878