CID 11491355

Bis(3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctyl)tin oxide

Structural Information

Molecular Formula
C16H8F26OSn
SMILES
C(C[Sn](=O)CCC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F
InChI
InChI=1S/2C8H4F13.O.Sn/c2*1-2-3(9,10)4(11,12)5(13,14)6(15,16)7(17,18)8(19,20)21;;/h2*1-2H2;;
InChIKey
VCPJPAQHWCNPKF-UHFFFAOYSA-N
Compound name
oxo-bis(3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctyl)tin
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

0
References

6
Patents

829.9182 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 830.925476 222.6
[M+Na]+ 852.907418 226.5
[M-H]- 828.910924 233.2
[M+NH4]+ 847.952023 235.4
[M+K]+ 868.881358 241.1
[M+H-H2O]+ 812.915460 209.5
[M+HCOO]- 874.916401 238.2
[M+CH3COO]- 888.932051 268.2
[M+Na-2H]- 850.892866 221.5
[M]+ 829.91765142 218.5
[M]- 829.91874858 218.5
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe