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(2S,3R)-2-AZIDO-4,4,4-TRIFLUORO-3-HYDROXYBUTYRIC-ACID-ETHYLESTER
SpectraBase Compound ID A25IeCVlv7t
InChI InChI=1S/C6H8F3N3O3/c1-2-15-5(14)3(11-12-10)4(13)6(7,8)9/h3-4,13H,2H2,1H3/t3-,4+/m0/s1
InChIKey KUBBTBGTCZUDTK-IUYQGCFVSA-N
Mol Weight 227.14 g/mol
Molecular Formula C6H8F3N3O3
Exact Mass 227.051776 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9v0XGeJ5khZ
Name Ethyl 2S,3R-2-Azido-4,4,4-trifluoro3-hydroxybutyrate
CAS Registry Number 139657-78-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C6H8F3N3O3
InChI InChI=1S/C6H8F3N3O3/c1-2-15-5(14)3(11-12-10)4(13)6(7,8)9/h3-4,13H,2H2,1H3/t3-,4+/m0/s1
InChIKey KUBBTBGTCZUDTK-IUYQGCFVSA-N
Molecular Weight 227.143 g/mol
SMILES O[C@]([C@@](C(=O)OCC)(N=[N+]=[N-])[H])(C(F)(F)F)[H]
SPLASH splash10-004i-9200000000-5ff55716ccdbd6532920
Source of Spectrum K-125-1277-4
Synonyms Ethyl (2S,3R)-2-azido-4,4,4-trifluoro-3-hydroxybutanoate
Wiley ID 1228314