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1,6-Bis[(p-methoxyphenyl)(diphenyl)methyl]-D-mannitol
SpectraBase Compound ID EgwyiSwSypB
InChI InChI=1S/C46H46O8/c1-51-39-27-23-37(24-28-39)45(33-15-7-3-8-16-33,34-17-9-4-10-18-34)53-31-41(47)43(49)44(50)42(48)32-54-46(35-19-11-5-12-20-35,36-21-13-6-14-22-36)38-25-29-40(52-2)30-26-38/h3-30,41-44,47-50H,31-32H2,1-2H3/t41-,42-,43-,44-/m1/s1
InChIKey XERHCULNKDJNHW-OWIHLRRYSA-N
Mol Weight 726.9 g/mol
Molecular Formula C46H46O8
Exact Mass 726.319268 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID nwXZGAxL0m
Name 1,6-Bis[(p-methoxyphenyl)(diphenyl)methyl]-D-mannitol
Alternate Name(s) 1,6-Bis-o-[(p-methoxyphenyl)(diphenyl)methyl]-D-mannitol 1,8-Dideoxy-1,8-bis(4-methoxyphenyl)-1,1,8,8-tetraphenyl-D-manno-octitol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C46H46O8
InChI InChI=1S/C46H46O8/c1-51-39-27-23-37(24-28-39)45(33-15-7-3-8-16-33,34-17-9-4-10-18-34)53-31-41(47)43(49)44(50)42(48)32-54-46(35-19-11-5-12-20-35,36-21-13-6-14-22-36)38-25-29-40(52-2)30-26-38/h3-30,41-44,47-50H,31-32H2,1-2H3/t41-,42-,43-,44-/m1/s1
InChIKey XERHCULNKDJNHW-OWIHLRRYSA-N
Molecular Weight 726.866 g/mol
SMILES O[C@@]([C@]([C@@]([C@@](COC(c1ccc(cc1)OC)(c1ccccc1)c1ccccc1)(O)[H])(O)[H])(O)[H])(COC(c1ccc(OC)cc1)(c1ccccc1)c1ccccc1)[H]
SPLASH splash10-00di-0090000000-c83626af9b85439df2a9
Source of Spectrum F-56-2199-17
Wiley ID 856517