| SpectraBase Spectrum ID |
DeSLL1R5Vl6 |
| Name |
N-((1R,4s,7S)-4-(4-Chlorophenyl)-8-oxabicyclo[5.1.0]octan-4-yl)-4-methylbenzenesulfonamide |
| Appearance |
White solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C20H22ClNO3S |
| InChI |
InChI=1S/C20H22ClNO3S/c1-14-2-8-17(9-3-14)26(23,24)22-20(15-4-6-16(21)7-5-15)12-10-18-19(25-18)11-13-20/h2-9,18-19,22H,10-13H2,1H3/t18-,19+,20- |
| InChIKey |
UKCOICLCRSDIHP-ACDBMABISA-N |
| Instrument Name |
Agilent 7890A-5975C |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/anie.202000650 |
| Molecular Weight |
391.913 g/mol |
| Reported Formula |
C20H22ClNO3S |
| SMILES |
N(S(=O)(=O)c1ccc(cc1)C)[C@]1(c2ccc(cc2)Cl)CC[C@]2([C@@](CC1)(O2)[H])[H] |
| SPLASH |
splash10-0a4i-1191000000-90bfd0ded33d22467d21 |
| Sample Comments |
mixture of diastereoisomers (trans/cis, 1:1.4) |
| Source of Spectrum |
ACI-59-SM35-1m |
| Wiley ID |
1857743 |
![N-((1R,4s,7S)-4-(4-Chlorophenyl)-8-oxabicyclo[5.1.0]octan-4-yl)-4-methylbenzenesulfonamide](/api/spectrum/DeSLL1R5Vl6/structure.png?h=300&w=458 "N-((1R,4s,7S)-4-(4-Chlorophenyl)-8-oxabicyclo[5.1.0]octan-4-yl)-4-methylbenzenesulfonamide")
