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(D,L)-1.alpha.,2.alpha.,3.beta.,4.beta.-1,2-Anhydro-3-O,4-N-carbonyl-5,5-difluoro-4-(methylamino)cyclohexane-1,2,3-triol
SpectraBase Compound ID FL3XYpZFnT2
InChI InChI=1S/C8H9F2NO3/c1-11-6-5(14-7(11)12)4-3(13-4)2-8(6,9)10/h3-6H,2H2,1H3/t3-,4+,5-,6-/m0/s1
InChIKey QJPUWDZZMKPFAJ-FSIIMWSLSA-N
Mol Weight 205.16 g/mol
Molecular Formula C8H9F2NO3
Exact Mass 205.055049 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BXVfbBaa84u
Name (D,L)-1.alpha.,2.alpha.,3.beta.,4.beta.-1,2-Anhydro-3-O,4-N-carbonyl-5,5-difluoro-4-(methylamino)cyclohexane-1,2,3-triol
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Formula C8H9F2NO3
InChI InChI=1S/C8H9F2NO3/c1-11-6-5(14-7(11)12)4-3(13-4)2-8(6,9)10/h3-6H,2H2,1H3/t3-,4+,5-,6-/m0/s1
InChIKey QJPUWDZZMKPFAJ-FSIIMWSLSA-N
Molecular Weight 205.161 g/mol
SMILES [C@@]12([C@]3([C@](N(C)C(O3)=O)(C(C[C@]1([H])O2)(F)F)[H])[H])[H]
SPLASH splash10-0a4i-0590000000-66599031bb01a31b5da0
Source of Spectrum K-127-1694-0
Wiley ID 1203192