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3-O-acetyl-1,2:4,6-di-O-isopropylidene-.alpha.-D-glucopyranose
SpectraBase Compound ID 6O168aeylJN
InChI InChI=1S/C14H22O7/c1-7(15)17-10-9-8(6-16-13(2,3)19-9)18-12-11(10)20-14(4,5)21-12/h8-12H,6H2,1-5H3/t8-,9-,10+,11-,12-/m1/s1
InChIKey JUKKIKUNMYSNCL-RMPHRYRLSA-N
Mol Weight 302.32 g/mol
Molecular Formula C14H22O7
Exact Mass 302.136553 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 29W9hCIMbpx
Name 3-O-acetyl-1,2:4,6-di-O-isopropylidene-.alpha.-D-glucopyranose
Alternate Name(s) (1R,3R,7R,8S,9R)-5,5,11,11-tetramethyl-2,4,6,10,12-pentaoxatricyclo[7.4.0.0(3,7)]tridecan-8-yl acetate
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Formula C14H22O7
InChI InChI=1S/C14H22O7/c1-7(15)17-10-9-8(6-16-13(2,3)19-9)18-12-11(10)20-14(4,5)21-12/h8-12H,6H2,1-5H3/t8-,9-,10+,11-,12-/m1/s1
InChIKey JUKKIKUNMYSNCL-RMPHRYRLSA-N
Molecular Weight 302.323 g/mol
SMILES [C@@]12([C@]([C@@]3(OC(C)(C)OC[C@]3(O[C@@]2(OC(O1)(C)C)[H])[H])[H])(OC(=O)C)[H])[H]
SPLASH splash10-0006-3980000000-1d86d97b6f2ccce18abd
Source of Spectrum KC-1981-3180-0
Wiley ID 110577