For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
(2S,3S)-3-deuterio-4-hydroxy-2-[(2,2,2-trifluoro-1-oxoethyl)amino]butanoic acid propan-2-yl ester
SpectraBase Compound ID 9AI8BAduTbA
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+/m1
InChIKey MZBULHHLMXGPKF-LTUSASFJSA-N
Mol Weight 258.22 g/mol
Molecular Formula C9H13DF3NO4
Exact Mass 258.093769 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID JoyCi6FyurM
Name (2S,3S)-3-deuterio-4-hydroxy-2-[(2,2,2-trifluoro-1-oxoethyl)amino]butanoic acid propan-2-yl ester
Alternate Name(s) (2S,3S)-3-deuterio-4-hydroxy-2-[(2,2,2-trifluoroacetyl)amino]butyric acid isopropyl ester isopropyl (2S,3S)-3-deuterio-4-hydroxy-2-[(2,2,2-trifluoroacetyl)amino]butanoate Propan-2-yl (2S,3S)-3-deuterio-4-hydroxy-2-[(2,2,2-trifluoroacetyl)amino]butanoate Propan-2-yl (2S,3S)-3-deuterio-4-oxidanyl-2-[2,2,2-tris(fluoranyl)ethanoylamino]butanoate
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+/m1
InChIKey MZBULHHLMXGPKF-LTUSASFJSA-N
Molecular Weight 258.215 g/mol
SMILES N([C@@]([C@@](CO)([D])[H])(C(OC(C)C)=O)[H])C(C(F)(F)F)=O
SPLASH splash10-0006-7920000000-7ad2c88c5f4dfdfb7151
Source of Spectrum KC-0-687-11
Wiley ID 785294