| SpectraBase Spectrum ID |
GVTQZppiFQ3 |
| Name |
rac-(1S,2R,3S,4S,5S,6R,7R,8S)-7,8-dichloro-4-(4-methylbenzenesulfonamido)bicyclo[4.2.0]octane-2,3,5-triyl triacetate |
| Appearance |
White crystals |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H25Cl2NO8S |
| InChI |
InChI=1S/C21H25Cl2NO8S/c1-9-5-7-13(8-6-9)33(28,29)24-18-19(30-10(2)25)14-15(17(23)16(14)22)20(31-11(3)26)21(18)32-12(4)27/h5-8,14-21,24H,1-4H3/t14-,15+,16+,17-,18-,19-,20+,21-/m0/s1 |
| InChIKey |
FOPBWZZFEGTACR-MLNSIODZSA-N |
| Ionization Type |
EI |
| Literature Reference DOI |
10.3762/bjoc.6.15 |
| Molecular Weight |
522.396 g/mol |
| SMILES |
N([C@@]1([C@@]([C@@]([C@]2([C@@]([C@@]([C@]2([C@@]1(OC(C)=O)[H])[H])(Cl)[H])(Cl)[H])[H])(OC(C)=O)[H])(OC(C)=O)[H])[H])S(c1ccc(C)cc1)(=O)=O |
| SPLASH |
splash10-05fr-8090000000-ebb24491a392d47a7a38 |
| Source of Spectrum |
BJO-6-SM8-7 |
| Wiley ID |
1871641 |
![rac-(1S,2R,3S,4S,5S,6R,7R,8S)-7,8-dichloro-4-(4-methylbenzenesulfonamido)bicyclo[4.2.0]octane-2,3,5-triyl triacetate](/api/spectrum/GVTQZppiFQ3/structure.png?h=300&w=458 "rac-(1S,2R,3S,4S,5S,6R,7R,8S)-7,8-dichloro-4-(4-methylbenzenesulfonamido)bicyclo[4.2.0]octane-2,3,5-triyl triacetate")
