| SpectraBase Spectrum ID |
B3r0J7B8Ay0 |
| Name |
[(4R,5R)-2,2-dimethyl-5-(phenylmethoxymethyl)-1,3-dioxolan-4-yl]methyl 4-methylbenzenesulfonate |
| CAS Registry Number |
78469-78-0 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H26O6S |
| InChI |
InChI=1S/C21H26O6S/c1-16-9-11-18(12-10-16)28(22,23)25-15-20-19(26-21(2,3)27-20)14-24-13-17-7-5-4-6-8-17/h4-12,19-20H,13-15H2,1-3H3/t19-,20-/m1/s1 |
| InChIKey |
FPAPIFXWWVBCHH-WOJBJXKFSA-N |
| Molecular Weight |
406.493 g/mol |
| SMILES |
C(OS(c1ccc(cc1)C)(=O)=O)[C@]1(OC(C)(C)O[C@@]1(COCc1ccccc1)[H])[H] |
| SPLASH |
splash10-0006-0009100000-422026e33a252cdd6b2b |
| Source of Spectrum |
H-64-696-0 |
| Synonyms |
4-methylbenzenesulfonic acid [(4R,5R)-2,2-dimethyl-5-(phenylmethoxymethyl)-1,3-dioxolan-4-yl]methyl ester
[(4R,5R)-5-(benzyloxymethyl)-2,2-dimethyl-1,3-dioxolan-4-yl]methyl 4-methylbenzenesulfonate |
| Wiley ID |
1372072 |
![[(4R,5R)-2,2-dimethyl-5-(phenylmethoxymethyl)-1,3-dioxolan-4-yl]methyl 4-methylbenzenesulfonate](/api/spectrum/B3r0J7B8Ay0/structure.png?h=300&w=458 "[(4R,5R)-2,2-dimethyl-5-(phenylmethoxymethyl)-1,3-dioxolan-4-yl]methyl 4-methylbenzenesulfonate")
