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2-(hydroxymethyl)-6-[4-(trifluoromethoxy)anilino]oxane-3,4,5-triol
SpectraBase Compound ID CK4KP27BtEq
InChI InChI=1S/C13H16F3NO6/c14-13(15,16)23-7-3-1-6(2-4-7)17-12-11(21)10(20)9(19)8(5-18)22-12/h1-4,8-12,17-21H,5H2/t8-,9+,10+,11-,12-/m0/s1
InChIKey XIYLYQRUHQXBBZ-KNZXXDILSA-N
Mol Weight 339.27 g/mol
Molecular Formula C13H16F3NO6
Exact Mass 339.092972 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID H3AAXSnYbrZ
Name 2-(hydroxymethyl)-6-[4-(trifluoromethoxy)anilino]oxane-3,4,5-triol
Alternate Name(s) 2-(hydroxymethyl)-6-[4-(trifluoromethoxy)anilino]tetrahydropyran-3,4,5-triol 2-(hydroxymethyl)-6-[[4-(trifluoromethyloxy)phenyl]amino]oxane-3,4,5-triol 2-Methylol-6-[4-(trifluoromethoxy)anilino]tetrahydropyran-3,4,5-triol N-[4-(trifluoromethoxy)phenyl]hexopyranosylamine
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Formula C13H16F3NO6
InChI InChI=1S/C13H16F3NO6/c14-13(15,16)23-7-3-1-6(2-4-7)17-12-11(21)10(20)9(19)8(5-18)22-12/h1-4,8-12,17-21H,5H2/t8-,9+,10+,11-,12-/m0/s1
InChIKey XIYLYQRUHQXBBZ-KNZXXDILSA-N
Molecular Weight 339.267 g/mol
SMILES O[C@]1([C@@]([C@](O[C@]([C@]1(O)[H])(CO)[H])(Nc1ccc(OC(F)(F)F)cc1)[H])(O)[H])[H]
SPLASH splash10-0a4i-9430000000-09c688e1522ee063e57c
Wiley ID 1452471