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3,5-O-isopropylidene-1,1,6-tri-C-phenyl-D-glycero-D-gulo-hexitol
SpectraBase Compound ID 6NefRZ4imop
InChI InChI=1S/C27H30O6/c1-26(2)32-23(21(28)18-12-6-3-7-13-18)22(29)24(33-26)25(30)27(31,19-14-8-4-9-15-19)20-16-10-5-11-17-20/h3-17,21-25,28-31H,1-2H3/t21-,22+,23-,24-,25-/m1/s1
InChIKey RYPILPQXJHQVPA-QERLCLQCSA-N
Mol Weight 450.53 g/mol
Molecular Formula C27H30O6
Exact Mass 450.204239 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Bi33whrE522
Name 3,5-O-isopropylidene-1,1,6-tri-C-phenyl-D-glycero-D-gulo-hexitol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H30O6
InChI InChI=1S/C27H30O6/c1-26(2)32-23(21(28)18-12-6-3-7-13-18)22(29)24(33-26)25(30)27(31,19-14-8-4-9-15-19)20-16-10-5-11-17-20/h3-17,21-25,28-31H,1-2H3/t21-,22+,23-,24-,25-/m1/s1
InChIKey RYPILPQXJHQVPA-QERLCLQCSA-N
Molecular Weight 450.531 g/mol
SMILES OC([C@@]([C@@]1(OC(O[C@@]([C@@]1(O)[H])([C@@](c1ccccc1)(O)[H])[H])(C)C)[H])(O)[H])(c1ccccc1)c1ccccc1
SPLASH splash10-0560-2900000000-09bd2dcebc6d68254801
Source of Spectrum J-60-3128-15
Synonyms (1R)-2,4-O-(1-methylethylidene)-1,6,6-tri-C-phenyl-L-glucitol
Wiley ID 1387802