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2-[((2R,3R)-3-{2-[((2R,3R)-3-hydroxy(tetrahydro-2H-pyran-2-yl)methoxy]ethoxy}tetrahydro-2H-pyran-2-yl)methoxy]ethyl 4-methylbenzebesulfonate
SpectraBase Compound ID 9IOBVMwkDOx
InChI InChI=1S/C23H36O9S/c1-18-6-8-19(9-7-18)33(25,26)32-15-13-28-17-23-21(5-3-11-30-23)31-14-12-27-16-22-20(24)4-2-10-29-22/h6-9,20-24H,2-5,10-17H2,1H3/t20-,21-,22-,23-/m1/s1
InChIKey UCEVBLQYUDSPQQ-SSGKUCQKSA-N
Mol Weight 488.6 g/mol
Molecular Formula C23H36O9S
Exact Mass 488.208004 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 33njaTUfM1p
Name 2-[((2R,3R)-3-{2-[((2R,3R)-3-hydroxy(tetrahydro-2H-pyran-2-yl)methoxy]ethoxy}tetrahydro-2H-pyran-2-yl)methoxy]ethyl 4-methylbenzebesulfonate
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Formula C23H36O9S
InChI InChI=1S/C23H36O9S/c1-18-6-8-19(9-7-18)33(25,26)32-15-13-28-17-23-21(5-3-11-30-23)31-14-12-27-16-22-20(24)4-2-10-29-22/h6-9,20-24H,2-5,10-17H2,1H3/t20-,21-,22-,23-/m1/s1
InChIKey UCEVBLQYUDSPQQ-SSGKUCQKSA-N
Molecular Weight 488.592 g/mol
SMILES O[C@]1([C@@](COCCO[C@]2([C@@](COCCOS(c3ccc(cc3)C)(=O)=O)(OCCC2)[H])[H])(OCCC1)[H])[H]
SPLASH splash10-0002-9700000000-5a828c19fc9b9a4ea1dc
Source of Spectrum KC-61-8190-47
Wiley ID 1630200