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(2S,3R)-3-deuterio-4-hydroxy-2-[(2,2,2-trifluoro-1-oxoethyl)amino]butanoic acid propan-2-yl ester
SpectraBase Compound ID CU2c4OQYuCj
InChI InChI=1S/C9H14F3NO4/c1-5(2)17-7(15)6(3-4-14)13-8(16)9(10,11)12/h5-6,14H,3-4H2,1-2H3,(H,13,16)/t6-/m0/s1/i3D/t3-,6-
InChIKey MZBULHHLMXGPKF-UBJMWOBBSA-N
Mol Weight 258.22 g/mol
Molecular Formula C9H132DF3NO4
Exact Mass 258.093769 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8MxQVhdz2p7
Name (2S,3R)-3-deuterio-4-hydroxy-2-[(2,2,2-trifluoro-1-oxoethyl)amino]butanoic acid propan-2-yl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H13DF3NO4
InChI InChI=1S/C9H14F3NO4/c1-5(2)17-7(15)6(3-4-14)13-8(16)9(10,11)12/h5-6,14H,3-4H2,1-2H3,(H,13,16)/t6-/m0/s1/i3D/t3-,6-
InChIKey MZBULHHLMXGPKF-UBJMWOBBSA-N
Molecular Weight 258.215 g/mol
SMILES N(C(C(F)(F)F)=O)[C@@]([C@@](CO)([H])[2D])(C(OC(C)C)=O)[H]
SPLASH splash10-052f-9830000000-f8e57bd3b0feaa88e600
Source of Spectrum KC-0-687-11
Synonyms (2S,3R)-3-deuterio-4-hydroxy-2-[(2,2,2-trifluoroacetyl)amino]butyric acid isopropyl ester isopropyl (2S,3R)-3-deuterio-4-hydroxy-2-[(2,2,2-trifluoroacetyl)amino]butanoate Propan-2-yl (2S,3R)-3-deuterio-4-hydroxy-2-[(2,2,2-trifluoroacetyl)amino]butanoate Propan-2-yl (2S,3R)-3-deuterio-4-oxidanyl-2-[2,2,2-tris(fluoranyl)ethanoylamino]butanoate
Wiley ID 785295