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p-Methylphenylsulfinyl 2,3-di-O-benzoyl-6-tert-butyldiphenyl-.beta.,D-galactopyranoside
SpectraBase Compound ID CgWyXkmsT4a
InChI InChI=1S/C43H44O8SSi/c1-30-25-27-33(28-26-30)52(47)42-39(51-41(46)32-19-11-6-12-20-32)38(50-40(45)31-17-9-5-10-18-31)37(44)36(49-42)29-48-53(43(2,3)4,34-21-13-7-14-22-34)35-23-15-8-16-24-35/h5-28,36-39,42,44H,29H2,1-4H3/t36-,37+,38+,39-,42+,52?/m1/s1
InChIKey SYPXAVJTPNYVCY-ATVINGRUSA-N
Mol Weight 749.0 g/mol
Molecular Formula C43H44O8SSi
Exact Mass 748.252616 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3pMQDTJpdUG
Name p-Methylphenylsulfinyl 2,3-di-O-benzoyl-6-tert-butyldiphenyl-.beta.,D-galactopyranoside
Comments Less than 3 mono-isotopic peaks
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Formula C43H44O8SSi
InChI InChI=1S/C43H44O8SSi/c1-30-25-27-33(28-26-30)52(47)42-39(51-41(46)32-19-11-6-12-20-32)38(50-40(45)31-17-9-5-10-18-31)37(44)36(49-42)29-48-53(43(2,3)4,34-21-13-7-14-22-34)35-23-15-8-16-24-35/h5-28,36-39,42,44H,29H2,1-4H3/t36-,37+,38+,39-,42+,52?/m1/s1
InChIKey SYPXAVJTPNYVCY-ATVINGRUSA-N
Molecular Weight 748.962 g/mol
SMILES O[C@]1([C@](O[C@]([C@@]([C@]1(OC(=O)c1ccccc1)[H])(OC(=O)c1ccccc1)[H])(S(c1ccc(cc1)C)=O)[H])(CO[Si](C(C)(C)C)(c1ccccc1)c1ccccc1)[H])[H]
SPLASH splash10-001r-0000000900-a8918dd2c6a65b38bd67
Source of Spectrum F-69-2887-23
Synonyms (1S)-1,5-anhydro-2,3-di-O-benzoyl-6-O-[tert-butyl(diphenyl)silyl]-1-[(4-methylphenyl)sulfinyl]-D-galactitol
Wiley ID 1594899