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(S)-5,5,5,5',5',5'-Hexafluoroleucine-hydrochloide
SpectraBase Compound ID 8jNDRECUFoT
InChI InChI=1S/C6H7F6NO2.Cl/c7-5(8,9)3(6(10,11)12)1-2(13)4(14)15;/h2-3H,1,13H2,(H,14,15);/t2-;/m0./s1
InChIKey AFCZGBIPNUDZFZ-DKWTVANSSA-N
Mol Weight 274.57 g/mol
Molecular Formula C6H7ClF6NO2
Exact Mass 274.00695 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9psC8AjZVil
Name (S)-5,5,5,5',5',5'-Hexafluoroleucine-hydrochloide
Alternate Name(s) (2S)-2-amino-5,5,5-trifluoro-4-(trifluoromethyl)pentanoic acid hydrochloride (2S)-2-amino-5,5,5-trifluoro-4-(trifluoromethyl)valeric acid hydrochloride (2S)-2-azanyl-5,5,5-tris(fluoranyl)-4-(trifluoromethyl)pentanoic acid hydrochloride [(1S)-1-carboxy-4,4,4-trifluoro-3-(trifluoromethyl)butyl]ammonium chloride [(2S)-5,5,5-trifluoro-1-hydroxy-1-oxo-4-(trifluoromethyl)pentan-2-yl]ammonium chloride [(2S)-5,5,5-trifluoro-1-hydroxy-1-oxo-4-(trifluoromethyl)pentan-2-yl]azanium chloride [(2S)-5,5,5-tris(fluoranyl)-1-oxidanyl-1-oxidanylidene-4-(trifluoromethyl)pentan-2-yl]azanium chloride [(1S)-1-carboxy-4,4,4-trifluoro-3-(trifluoromethyl)butyl]azanium;chloride [(2S)-5,5,5-tris(fluoranyl)-1-oxidanyl-1-oxidanylidene-4-(trifluoromethyl)pentan-2-yl]azanium;chloride
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Formula C6H8ClF6NO2
InChI InChI=1S/C6H7F6NO2.Cl/c7-5(8,9)3(6(10,11)12)1-2(13)4(14)15;/h2-3H,1,13H2,(H,14,15);/t2-;/m0./s1
InChIKey AFCZGBIPNUDZFZ-DKWTVANSSA-N
Molecular Weight 275.578 g/mol
SMILES Cl.OC([C@](CC(C(F)(F)F)C(F)(F)F)(N)[H])=O
SPLASH splash10-0feo-2900000000-6f2a9815d219ddd2fb75
Source of Spectrum H-81-180-12
Wiley ID 1278797