SpectraBase Spectrum ID |
5We01jKhI3I |
Name |
1,6-di(p-Toluenesulfonyl)-2,4:3,5-dimethylene-L-iditol |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
514.096739375 u |
Formula |
C22H26O10S2 |
InChI |
InChI=1S/C22H26O10S2/c1-15-3-7-17(8-4-15)33(23,24)31-11-19-21-22(30-13-27-19)20(28-14-29-21)12-32-34(25,26)18-9-5-16(2)6-10-18/h3-10,19-22H,11-14H2,1-2H3 |
InChIKey |
GDTIUDCPGLAYJW-UHFFFAOYSA-N |
Molecular Weight |
514.560 g/mol |
SMILES |
C1OC(C2C(O1)C(OCO2)COS(=O)(=O)C1=CC=C(C=C1)C)COS(=O)(=O)C1=CC=C(C=C1)C |