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

8
Patents

829.9182 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 830.92548 222.6
[M+Na]+ 852.90742 226.5
[M-H]- 828.91092 233.2
[M+NH4]+ 847.95202 235.4
[M+K]+ 868.88136 241.1
[M+H-H2O]+ 812.91546 209.5
[M+HCOO]- 874.91640 238.2
[M+CH3COO]- 888.93205 268.2
[M+Na-2H]- 850.89287 221.5
[M]+ 829.91765 218.5
[M]- 829.91875 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