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2-[2',3',5'-tris-( O-Benzyl)-.beta.-D-ribofuranosyl]-3,6-bis(trifluoromethyl)pyridine
SpectraBase Compound ID BSfTQ3ykDqE
InChI InChI=1S/C33H29F6NO4/c34-32(35,36)25-16-17-27(33(37,38)39)40-28(25)30-31(43-20-24-14-8-3-9-15-24)29(42-19-23-12-6-2-7-13-23)26(44-30)21-41-18-22-10-4-1-5-11-22/h1-17,26,29-31H,18-21H2/t26-,29-,30+,31-/m1/s1
InChIKey WYWBJOLLKZCOLF-ZQSJDURZSA-N
Mol Weight 617.6 g/mol
Molecular Formula C33H29F6NO4
Exact Mass 617.200077 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 31oNahjYIwi
Name 2-[2',3',5'-tris-( O-Benzyl)-.beta.-D-ribofuranosyl]-3,6-bis(trifluoromethyl)pyridine
Alternate Name(s) 1,4-anhydro-2,3,5-tri-O-benzyl-1-[3,6-bis(trifluoromethyl)-2-pyridinyl]pentitol
Comments Less than 3 mono-isotopic peaks
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Formula C33H29F6NO4
InChI InChI=1S/C33H29F6NO4/c34-32(35,36)25-16-17-27(33(37,38)39)40-28(25)30-31(43-20-24-14-8-3-9-15-24)29(42-19-23-12-6-2-7-13-23)26(44-30)21-41-18-22-10-4-1-5-11-22/h1-17,26,29-31H,18-21H2/t26-,29-,30+,31-/m1/s1
InChIKey WYWBJOLLKZCOLF-ZQSJDURZSA-N
Molecular Weight 617.588 g/mol
SMILES [C@@]1(c2c(C(F)(F)F)ccc(C(F)(F)F)n2)([C@@]([C@](OCc2ccccc2)([C@](O1)(COCc1ccccc1)[H])[H])(OCc1ccccc1)[H])[H]
SPLASH splash10-004i-0000090000-8a37ffba18e8b4379348
Source of Spectrum D8-328-179-17
Wiley ID 1515716