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(2S,3R,4R)-1-O-Acetyl-2,3,4-tri-O-benzyladonitol
SpectraBase Compound ID 1NxTO7HTsfH
InChI InChI=1S/C28H32O6/c1-22(30)31-21-27(33-19-24-13-7-3-8-14-24)28(34-20-25-15-9-4-10-16-25)26(17-29)32-18-23-11-5-2-6-12-23/h2-16,26-29H,17-21H2,1H3/t26-,27+,28-/m1/s1
InChIKey KFHUHXSGBCJSPN-OZNIXHKMSA-N
Mol Weight 464.6 g/mol
Molecular Formula C28H32O6
Exact Mass 464.219889 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8b3qHyhAAwQ
Name (2S,3R,4R)-1-O-Acetyl-2,3,4-tri-O-benzyladonitol
Alternate Name(s) 1-O-acetyl-2,3,4-tri-O-benzyl-D-ribitol
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H32O6
InChI InChI=1S/C28H32O6/c1-22(30)31-21-27(33-19-24-13-7-3-8-14-24)28(34-20-25-15-9-4-10-16-25)26(17-29)32-18-23-11-5-2-6-12-23/h2-16,26-29H,17-21H2,1H3/t26-,27+,28-/m1/s1
InChIKey KFHUHXSGBCJSPN-OZNIXHKMSA-N
Molecular Weight 464.558 g/mol
SMILES OC[C@]([C@@](OCc1ccccc1)([C@@](OCc1ccccc1)(COC(=O)C)[H])[H])(OCc1ccccc1)[H]
SPLASH splash10-0006-9000000000-4df46cedc69f5fd9396d
Source of Spectrum J-57-1106-5
Wiley ID 1391588