| SpectraBase Spectrum ID |
LfzplZI7h6t |
| Name |
[(4S,5S)-5-(hydroxymethyl)-2,2-dimethyl-1,3-dioxolan-4-yl]methyl 4-methylbenzenesulfonate |
| CAS Registry Number |
58789-44-9 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C14H20O6S |
| InChI |
InChI=1S/C14H20O6S/c1-10-4-6-11(7-5-10)21(16,17)18-9-13-12(8-15)19-14(2,3)20-13/h4-7,12-13,15H,8-9H2,1-3H3/t12-,13-/m0/s1 |
| InChIKey |
OKTMEOCGDWUZIU-STQMWFEESA-N |
| Molecular Weight |
316.368 g/mol |
| SMILES |
OC[C@@]1(OC(O[C@]1(COS(c1ccc(cc1)C)(=O)=O)[H])(C)C)[H] |
| SPLASH |
splash10-0udi-0009000000-3eebc39f7977cf131dba |
| Source of Spectrum |
E1-38-1448-7 |
| Synonyms |
4-methylbenzenesulfonic acid [(4S,5S)-5-(hydroxymethyl)-2,2-dimethyl-1,3-dioxolan-4-yl]methyl ester |
| Wiley ID |
1518406 |
![[(4S,5S)-5-(hydroxymethyl)-2,2-dimethyl-1,3-dioxolan-4-yl]methyl 4-methylbenzenesulfonate](/api/spectrum/LfzplZI7h6t/structure.png?h=300&w=458 "[(4S,5S)-5-(hydroxymethyl)-2,2-dimethyl-1,3-dioxolan-4-yl]methyl 4-methylbenzenesulfonate")
