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1,2:5,6-Di-O isopropylidene-.alpha.,D-allofuranose (R)-1-(4-tert-Bytylphenyl)-2-phenylethanesulfonate
SpectraBase Compound ID Bt8D0ZS7WT4
InChI InChI=1S/C30H40O8S/c1-28(2,3)21-15-13-20(14-16-21)23(17-19-11-9-8-10-12-19)39(31,32)38-25-24(22-18-33-29(4,5)35-22)34-27-26(25)36-30(6,7)37-27/h8-16,22-27H,17-18H2,1-7H3/t22-,23-,24-,25-,26-,27-/m1/s1
InChIKey ZRYBKCRSSQOQNY-ZRRJEQDASA-N
Mol Weight 560.7 g/mol
Molecular Formula C30H40O8S
Exact Mass 560.244389 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID E7pJDfZP0xG
Name 1,2:5,6-Di-O isopropylidene-.alpha.,D-allofuranose (R)-1-(4-tert-Bytylphenyl)-2-phenylethanesulfonate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H40O8S
InChI InChI=1S/C30H40O8S/c1-28(2,3)21-15-13-20(14-16-21)23(17-19-11-9-8-10-12-19)39(31,32)38-25-24(22-18-33-29(4,5)35-22)34-27-26(25)36-30(6,7)37-27/h8-16,22-27H,17-18H2,1-7H3/t22-,23-,24-,25-,26-,27-/m1/s1
InChIKey ZRYBKCRSSQOQNY-ZRRJEQDASA-N
Molecular Weight 560.702 g/mol
SMILES [C@@]1(OS([C@@](c2ccc(C(C)(C)C)cc2)(Cc2ccccc2)[H])(=O)=O)([C@@]2([C@@](OC(O2)(C)C)(O[C@@]1([C@@]1(OC(C)(C)OC1)[H])[H])[H])[H])[H]
SPLASH splash10-000i-1090020000-ff6538e6c1daa40661fa
Source of Spectrum KC-61-3240-20
Wiley ID 1628333