| SpectraBase Compound ID | Egas9BhFQwN |
|---|---|
| InChI | InChI=1S/C4H6F3NO3/c5-4(6,7)2(9)1(8)3(10)11/h1-2,9H,8H2,(H,10,11)/t1-,2+/m0/s1 |
| InChIKey | ITYVCUQVLKIGEY-NHYDCYSISA-N |
| Mol Weight | 173.09 g/mol |
| Molecular Formula | C4H6F3NO3 |
| Exact Mass | 173.029978 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 2T6xCyUuD8b |
|---|---|
| Name | L-Threonine, 4,4,4-trifluoro- |
| Alternate Name(s) | (2S,3R)-2-amino-4,4,4-trifluoro-3-hydroxy-butanoic acid (2S,3R)-2-amino-4,4,4-trifluoro-3-hydroxy-butyric acid (2S,3R)-2-ammonio-4,4,4-trifluoro-3-hydroxy-butyrate (2S,3R)-2-ammonio-4,4,4-trifluoro-3-hydroxybutanoate (2S,3R)-2-azaniumyl-4,4,4-trifluoro-3-hydroxy-butanoate (2S,3R)-2-azaniumyl-4,4,4-tris(fluoranyl)-3-oxidanyl-butanoate (2S,3R)-2-azanyl-4,4,4-tris(fluoranyl)-3-oxidanyl-butanoic acid |
| CAS Registry Number | 111688-37-0 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C4H6F3NO3 |
| InChI | InChI=1S/C4H6F3NO3/c5-4(6,7)2(9)1(8)3(10)11/h1-2,9H,8H2,(H,10,11)/t1-,2+/m0/s1 |
| InChIKey | ITYVCUQVLKIGEY-NHYDCYSISA-N |
| Molecular Weight | 173.091 g/mol |
| SMILES | OC([C@]([C@](C(F)(F)F)(O)[H])(N)[H])=O |
| SPLASH | splash10-00fr-9300000000-4d4eeca4f47b78a9b843 |
| Source of Spectrum | H-70-257-30 |
| Wiley ID | 1169564 |