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D-Fructose, O-(phenylmethyl)oxime, 1,3,4,5,6-pentabenzoate
SpectraBase Compound ID HQkn5Zu8VAe
InChI InChI=1S/C48H39NO11/c50-44(35-21-9-2-10-22-35)55-32-40(49-57-31-34-19-7-1-8-20-34)42(59-47(53)38-27-15-5-16-28-38)43(60-48(54)39-29-17-6-18-30-39)41(58-46(52)37-25-13-4-14-26-37)33-56-45(51)36-23-11-3-12-24-36/h1-30,41-43H,31-33H2/b49-40+/t41-,42-,43-/m1/s1
InChIKey BCQSSVICCNLYDX-UOSIAEJQSA-N
Mol Weight 805.8 g/mol
Molecular Formula C48H39NO11
Exact Mass 805.252311 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AMd7EqRMABA
Name D-Fructose, O-(phenylmethyl)oxime, 1,3,4,5,6-pentabenzoate
CAS Registry Number 71641-44-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C48H39NO11
InChI InChI=1S/C48H39NO11/c50-44(35-21-9-2-10-22-35)55-32-40(49-57-31-34-19-7-1-8-20-34)42(59-47(53)38-27-15-5-16-28-38)43(60-48(54)39-29-17-6-18-30-39)41(58-46(52)37-25-13-4-14-26-37)33-56-45(51)36-23-11-3-12-24-36/h1-30,41-43H,31-33H2/b49-40+/t41-,42-,43-/m1/s1
InChIKey BCQSSVICCNLYDX-UOSIAEJQSA-N
Molecular Weight 805.836 g/mol
SMILES [C@]([C@](OC(=O)c1ccccc1)([C@](OC(=O)c1ccccc1)(COC(=O)c1ccccc1)[H])[H])(OC(=O)c1ccccc1)(\C(=N\OCc1ccccc1)COC(=O)c1ccccc1)[H]
SPLASH splash10-052f-9800010000-b6f9ff9b8ac75c14f5ee
Source of Spectrum KO-6-118-1
Synonyms (1E,2R,3S,4R)-2,4,5-tris(benzoyloxy)-1-[(benzoyloxy)methyl]-1-[(benzyloxy)imino]pentan-3-yl benzoate D-fructose-perbenzoyl O-benzyloxime
Wiley ID 1417220