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2-(3,5-Di-O-benzoyl-2-deoxy-.alpha.,D-erythro-pentofuranosyl)-2,2-difluoro-1-(3-O-benzyl-5-deoxy-1,2-O-isopropylidene-.alpha.,D-xylo-pentofuranosyl)ethanone
SpectraBase Compound ID DhBpy8zjM1Q
InChI InChI=1S/C36H36F2O10/c1-35(2)47-31-30(42-20-22-12-6-3-7-13-22)26(46-34(31)48-35)18-28(39)36(37,38)29-19-25(45-33(41)24-16-10-5-11-17-24)27(44-29)21-43-32(40)23-14-8-4-9-15-23/h3-17,25-27,29-31,34H,18-21H2,1-2H3/t25-,26+,27+,29-,30-,31+,34+/m0/s1
InChIKey WZWSJPBNIMUAMV-CVUPTQQFSA-N
Mol Weight 666.7 g/mol
Molecular Formula C36H36F2O10
Exact Mass 666.227654 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DwYODOzs4ux
Name 2-(3,5-Di-O-benzoyl-2-deoxy-.alpha.,D-erythro-pentofuranosyl)-2,2-difluoro-1-(3-O-benzyl-5-deoxy-1,2-O-isopropylidene-.alpha.,D-xylo-pentofuranosyl)ethanone
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Formula C36H36F2O10
InChI InChI=1S/C36H36F2O10/c1-35(2)47-31-30(42-20-22-12-6-3-7-13-22)26(46-34(31)48-35)18-28(39)36(37,38)29-19-25(45-33(41)24-16-10-5-11-17-24)27(44-29)21-43-32(40)23-14-8-4-9-15-23/h3-17,25-27,29-31,34H,18-21H2,1-2H3/t25-,26+,27+,29-,30-,31+,34+/m0/s1
InChIKey WZWSJPBNIMUAMV-CVUPTQQFSA-N
Molecular Weight 666.671 g/mol
SMILES [C@@]12([C@@](OC(O2)(C)C)(O[C@@]([C@@]1(OCc1ccccc1)[H])(CC(C([C@]1(O[C@](COC(=O)c2ccccc2)([C@](C1)(OC(=O)c1ccccc1)[H])[H])[H])(F)F)=O)[H])[H])[H]
SPLASH splash10-004i-0069621000-049e3d531acbee276e13
Source of Spectrum QE-7-908-13
Synonyms 2-(3,5-Di-O-benzoyl-2-deoxy-.alpha.,D-erythro-pentofuranosyl)-2,2-difluoro-1-(3-O-benzyl-5-deoxy-1,2-isopropylidene-.alpha.,D-xylo-pentofuranosyl)ethanone
Wiley ID 845394