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(-)-1,6-Dideoxy-2,5-di-O benzyl-3,4-O-isopropylidene-1,6-thio-D-sorbitol-S,S-dioxide
SpectraBase Compound ID v0xksiNR6N
InChI InChI=1S/C23H28O6S/c1-23(2)28-21-19(26-13-17-9-5-3-6-10-17)15-30(24,25)16-20(22(21)29-23)27-14-18-11-7-4-8-12-18/h3-12,19-22H,13-16H2,1-2H3/t19-,20+,21-,22-/m1/s1
InChIKey MEEQFBCMDLKWMR-CIAFKFPVSA-N
Mol Weight 432.53 g/mol
Molecular Formula C23H28O6S
Exact Mass 432.16066 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BQdyLZujrnI
Name (-)-1,6-Dideoxy-2,5-di-O benzyl-3,4-O-isopropylidene-1,6-thio-D-sorbitol-S,S-dioxide
Alternate Name(s) (-)-1,6-Dideoxy-2,5-di-O benzyl-3,4-O-isopropylidene-1,6-thio-D-mannitol-S,S-dioxide (3aS,4S,8R,8aS)-4,8-Bis-benzyloxy-2,2-dimethyl-hexahydro-thiepino[4,5-d][1,3]dioxole 6,6-dioxide
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Formula C23H28O6S
InChI InChI=1S/C23H28O6S/c1-23(2)28-21-19(26-13-17-9-5-3-6-10-17)15-30(24,25)16-20(22(21)29-23)27-14-18-11-7-4-8-12-18/h3-12,19-22H,13-16H2,1-2H3/t19-,20+,21-,22-/m1/s1
InChIKey MEEQFBCMDLKWMR-CIAFKFPVSA-N
Molecular Weight 432.531 g/mol
SMILES C1S(C[C@]([C@]2(OC(O[C@@]2([C@]1(OCc1ccccc1)[H])[H])(C)C)[H])(OCc1ccccc1)[H])(=O)=O
SPLASH splash10-0006-9001000000-f46079e11d1944fc139c
Source of Spectrum F-56-1228-6
Wiley ID 856044