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(S)-N-[(S)-3-Ethoxycarbonyl-3-(trifluoroacetylamino)propyl]-N-methylalanine ethyl ester
SpectraBase Compound ID BOWm5X569HO
InChI InChI=1S/C14H23F3N2O5/c1-5-23-11(20)9(3)19(4)8-7-10(12(21)24-6-2)18-13(22)14(15,16)17/h9-10H,5-8H2,1-4H3,(H,18,22)/t9-,10-/m0/s1
InChIKey WNFBIBVNFKPNRE-UWVGGRQHSA-N
Mol Weight 356.34 g/mol
Molecular Formula C14H23F3N2O5
Exact Mass 356.155906 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LeLUNyFOpzl
Name (S)-N-[(S)-3-Ethoxycarbonyl-3-(trifluoroacetylamino)propyl]-N-methylalanine ethyl ester
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Formula C14H23F3N2O5
InChI InChI=1S/C14H23F3N2O5/c1-5-23-11(20)9(3)19(4)8-7-10(12(21)24-6-2)18-13(22)14(15,16)17/h9-10H,5-8H2,1-4H3,(H,18,22)/t9-,10-/m0/s1
InChIKey WNFBIBVNFKPNRE-UWVGGRQHSA-N
Literature Reference DOI 10.1002/prac.19883300319
Molecular Weight 356.342 g/mol
SMILES N([C@@](CCN([C@](C(OCC)=O)(C)[H])C)(C(OCC)=O)[H])C(C(F)(F)F)=O
SPLASH splash10-001l-0691000000-cc67b6387a0e4784e510
Source of Spectrum JF-330-471-5
Synonyms Ethyl (S)-4-(((S)-1-ethoxy-1-oxopropan-2-yl)(methyl)amino)-2-(2,2,2-trifluoroacetamido)butanoate
Wiley ID 1791657