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4-(Dimethylamino)-2-[.beta.-D-ribofuranosyl]-3,6-bis(trifluoromethyl)pyridine
SpectraBase Compound ID JJOK2ni2hoi
InChI InChI=1S/C14H16F6N2O4/c1-22(2)5-3-7(13(15,16)17)21-9(8(5)14(18,19)20)12-11(25)10(24)6(4-23)26-12/h3,6,10-12,23-25H,4H2,1-2H3/t6-,10-,11-,12+/m1/s1
InChIKey IHKFYELGKWXUFU-ZNHSANFISA-N
Mol Weight 390.28 g/mol
Molecular Formula C14H16F6N2O4
Exact Mass 390.101426 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID C7lBDZJynL4
Name 4-(Dimethylamino)-2-[.beta.-D-ribofuranosyl]-3,6-bis(trifluoromethyl)pyridine
Alternate Name(s) (1S)-1,4-anhydro-1-[4-(dimethylamino)-3,6-bis(trifluoromethyl)-2-pyridinyl]-D-ribitol
Comments Less than 3 mono-isotopic peaks
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Formula C14H16F6N2O4
InChI InChI=1S/C14H16F6N2O4/c1-22(2)5-3-7(13(15,16)17)21-9(8(5)14(18,19)20)12-11(25)10(24)6(4-23)26-12/h3,6,10-12,23-25H,4H2,1-2H3/t6-,10-,11-,12+/m1/s1
InChIKey IHKFYELGKWXUFU-ZNHSANFISA-N
Molecular Weight 390.282 g/mol
SMILES O[C@@]1([C@@]([C@@](CO)(O[C@]1(c1c(c(cc(n1)C(F)(F)F)N(C)C)C(F)(F)F)[H])[H])(O)[H])[H]
SPLASH splash10-000i-0090000000-7427df406579940b23e6
Source of Spectrum D8-328-180-23
Wiley ID 1515712