| SpectraBase Spectrum ID |
K4lMNcVms47 |
| Name |
4-Chloro-2-((R)-((1,1-dimethylethyl)sulfonamido)(phenyl)methyl)phenyl (S)-2-methylpropane-2-sulfinate |
| Appearance |
White solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H28ClNO4S2 |
| InChI |
InChI=1S/C21H28ClNO4S2/c1-20(2,3)28(24)27-18-13-12-16(22)14-17(18)19(15-10-8-7-9-11-15)23-29(25,26)21(4,5)6/h7-14,19,23H,1-6H3/t19-,28?/m1/s1 |
| InChIKey |
PDRFRVXWNJOTMS-OJQMSQGESA-N |
| Instrument Name |
Hewlett-Packard 5971 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/adsc.202200113 |
| Molecular Weight |
458.031 g/mol |
| Optical Rotation |
[a]D20 = +130 (c = 1.4, CH2Cl2) |
| Reported Formula |
C21H28ClNO4S2 |
| SMILES |
N([C@@](c1c(O[S@](C(C)(C)C)=O)ccc(c1)Cl)(c1ccccc1)[H])S(C(C)(C)C)(=O)=O |
| SPLASH |
splash10-0a4i-9000000000-1d94a62991844c842cbe |
| Source of Spectrum |
ASC-364-SM17-8bB |
| Wiley ID |
1868499 |
