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1,5-Anhydro-3,4,6-tris(O-benzyl)-1,1-[1',2'-cyclohexanediyldioxy]-2-deoxyD-arabino-hexitol
SpectraBase Compound ID qcZ9g5B7F3
InChI InChI=1S/C33H38O6/c1-4-12-25(13-5-1)21-34-24-31-32(36-23-27-16-8-3-9-17-27)30(35-22-26-14-6-2-7-15-26)20-33(39-31)37-28-18-10-11-19-29(28)38-33/h1-9,12-17,28-32H,10-11,18-24H2/t28-,29-,30+,31?,32-/m0/s1
InChIKey IMCKBSIOVSCYGE-QJCOQRLKSA-N
Mol Weight 530.7 g/mol
Molecular Formula C33H38O6
Exact Mass 530.266839 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HqDGAnutUKO
Name 1,5-Anhydro-3,4,6-tris(O-benzyl)-1,1-[1',2'-cyclohexanediyldioxy]-2-deoxyD-arabino-hexitol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C33H38O6
InChI InChI=1S/C33H38O6/c1-4-12-25(13-5-1)21-34-24-31-32(36-23-27-16-8-3-9-17-27)30(35-22-26-14-6-2-7-15-26)20-33(39-31)37-28-18-10-11-19-29(28)38-33/h1-9,12-17,28-32H,10-11,18-24H2/t28-,29-,30+,31?,32-/m0/s1
InChIKey IMCKBSIOVSCYGE-QJCOQRLKSA-N
Molecular Weight 530.661 g/mol
SMILES C12(OC(COCc3ccccc3)[C@]([C@@](C1)(OCc1ccccc1)[H])(OCc1ccccc1)[H])O[C@]1(CCCC[C@@]1(O2)[H])[H]
SPLASH splash10-0006-9000000000-e02bd8ba0fb12df3a4ea
Source of Spectrum U-1993-449-3
Wiley ID 765053