| SpectraBase Spectrum ID |
E023p1Bo0A7 |
| Name |
Benzene, 1-chloro-4-[[2,2,3,3,4,4,4-heptafluoro-1,1-bis(trifluoromethyl)butyl]thio]- |
| Alternate Name(s) |
1-chloro-4-{[2,2,3,3,4,4,4-heptafluoro-1,1-bis(trifluoromethyl)butyl]sulfanyl}benzene
4-(4-Chlorophenythio)-4-trifluoromethyl-perfluoropentane
4-chlorophenyl 2,2,3,3,4,4,4-heptafluoro-1,1-bis(trifluoromethyl)butyl sulfide |
| CAS Registry Number |
115166-63-7 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C12H4ClF13S |
| InChI |
InChI=1S/C12H4ClF13S/c13-5-1-3-6(4-2-5)27-7(10(18,19)20,11(21,22)23)8(14,15)9(16,17)12(24,25)26/h1-4H |
| InChIKey |
STOJVCUTVPVYLP-UHFFFAOYSA-N |
| Molecular Weight |
462.656 g/mol |
| SMILES |
C(C(C(F)(F)F)(C(F)(F)F)Sc1ccc(cc1)Cl)(C(C(F)(F)F)(F)F)(F)F |
| SPLASH |
splash10-0006-0900300000-0e924345b4cbeb77e36a |
| Source of Spectrum |
AJ-60-4472-3 |
| Wiley ID |
1390872 |
![Benzene, 1-chloro-4-[[2,2,3,3,4,4,4-heptafluoro-1,1-bis(trifluoromethyl)butyl]thio]-](/api/spectrum/E023p1Bo0A7/structure.png?h=300&w=458 "Benzene, 1-chloro-4-[[2,2,3,3,4,4,4-heptafluoro-1,1-bis(trifluoromethyl)butyl]thio]-")
