| SpectraBase Spectrum ID |
7EwTEtt7UNu |
| Name |
3,3'-bis[ 3-(Trichloromethyl)sulfonyl)-3-propylallenyl]-[2.2]-paracyclophane |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C30H30Cl6O4S2 |
| InChI |
InChI=1S/C30H30Cl6O4S2/c1-3-5-27(41(37,38)29(31,32)33)17-15-25-19-21-7-8-22-10-12-24(14-13-23(25)11-9-21)26(20-22)16-18-28(6-4-2)42(39,40)30(34,35)36/h9-12,15-16,19-20H,3-8,13-14H2,1-2H3 |
| InChIKey |
KNYGBGHQXMLQBP-UHFFFAOYSA-N |
| Molecular Weight |
731.404 g/mol |
| SMILES |
C(S(C(=C=Cc1c2CCc3c(C=C=C(S(C(Cl)(Cl)Cl)(=O)=O)CCC)cc(CCc(c1)cc2)cc3)CCC)(=O)=O)(Cl)(Cl)Cl |
| SPLASH |
splash10-001i-0900000000-7c15b18809bc9e622f10 |
| Source of Spectrum |
HE-2005-642-4 |
| Wiley ID |
1613674 |
![3,3'-bis[ 3-(Trichloromethyl)sulfonyl)-3-propylallenyl]-[2.2]-paracyclophane](/api/spectrum/7EwTEtt7UNu/structure.png?h=300&w=458 "3,3'-bis[ 3-(Trichloromethyl)sulfonyl)-3-propylallenyl]-[2.2]-paracyclophane")
