| SpectraBase Spectrum ID |
IkkWy9N85pQ |
| Name |
Benzene, [[2,2,3,3,4,4,4-heptafluoro-1,1-bis(trifluoromethyl)butyl]thio]pentamethyl- |
| Alternate Name(s) |
1-{[2,2,3,3,4,4,4-heptafluoro-1,1-bis(trifluoromethyl)butyl]sulfanyl}-2,3,4,5,6-pentamethylbenzene
2,2,3,3,4,4,4-heptafluoro-1,1-bis(trifluoromethyl)butyl 2,3,4,5,6-pentamethylphenyl sulfide
4-(2,3,4,5,6-Pentamethylphenylthio)-4-trifluoromethyl-perfluoropentane |
| CAS Registry Number |
115166-62-6 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C17H15F13S |
| InChI |
InChI=1S/C17H15F13S/c1-6-7(2)9(4)11(10(5)8(6)3)31-12(15(22,23)24,16(25,26)27)13(18,19)14(20,21)17(28,29)30/h1-5H3 |
| InChIKey |
BVFQBNMTSCEJGB-UHFFFAOYSA-N |
| Molecular Weight |
498.346 g/mol |
| SMILES |
C(C(Sc1c(c(C)c(c(c1C)C)C)C)(C(F)(F)F)C(F)(F)F)(C(C(F)(F)F)(F)F)(F)F |
| SPLASH |
splash10-004i-0900100000-70d4545b8119d0165c27 |
| Source of Spectrum |
AJ-60-4472-3 |
| Wiley ID |
1398475 |
![Benzene, [[2,2,3,3,4,4,4-heptafluoro-1,1-bis(trifluoromethyl)butyl]thio]pentamethyl-](/api/spectrum/IkkWy9N85pQ/structure.png?h=300&w=458 "Benzene, [[2,2,3,3,4,4,4-heptafluoro-1,1-bis(trifluoromethyl)butyl]thio]pentamethyl-")
