CID 16046298
5-(tridecafluorohexyl)-2,2'-bithiophene
Structural Information
- Molecular Formula
- C14H5F13S2
- SMILES
- C1=CSC(=C1)C2=CC=C(S2)C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F
- InChI
- InChI=1S/C14H5F13S2/c15-9(16,8-4-3-7(29-8)6-2-1-5-28-6)10(17,18)11(19,20)12(21,22)13(23,24)14(25,26)27/h1-5H
- InChIKey
- KILCWELZTSEPSB-UHFFFAOYSA-N
- Compound name
- 2-thiophen-2-yl-5-(1,1,2,2,3,3,4,4,5,5,6,6,6-tridecafluorohexyl)thiophene
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 484.96978 | 187.8 |
[M+Na]+ | 506.95172 | 198.4 |
[M-H]- | 482.95522 | 180.1 |
[M+NH4]+ | 501.99632 | 198.9 |
[M+K]+ | 522.92566 | 192.3 |
[M+H-H2O]+ | 466.95976 | 173.3 |
[M+HCOO]- | 528.96070 | 183.4 |
[M+CH3COO]- | 542.97635 | 229.1 |
[M+Na-2H]- | 504.93717 | 186.8 |
[M]+ | 483.96195 | 174.9 |
[M]- | 483.96305 | 174.9 |
Literature stripe
No literature data available for this compound.